BMRBj - BMREntryMaster

Found 1 Document (0.52 seconds)

BMRB: 51858

Backbone and side-chain chemical shift assignments of the P44A mutant of the MazE9 antitoxin in Mycobacterium tuberculosis

Authors

Basu Roy, T., Sarma, S.P.

Assembly

MazE9 P44A

Entity

1. MazE9 P44A (polymer, Thiol state: not present), 79 monomers, 8468.141 × 2 Da Detail

SGSMKLSVSL SDDDVAILDA YVKRAGLPSR SAGLQHAIRV LRYATLEDDY ANAWQEWSAA GDTDAWEQTV GDGVGDAPR

Total weight

16936.281 Da

Max. entity weight

8468.141 Da

Source organism

Mycobacterium tuberculosis

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemical Shifts 1

¹H: 305, ¹³C: 98, ¹⁵N: 65 assignments Detail

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	2	GLY	CA	C	42.546	0.022	1
2	1	3	SER	H	H	8.130	0.001	1
3	1	3	SER	CA	C	55.210	0.038	1
4	1	3	SER	CB	C	62.315	0.050	1
5	1	3	SER	N	N	115.160	0.030	1
6	1	4	MET	H	H	8.878	0.007	1
7	1	4	MET	HA	H	4.570	0.035	1
8	1	4	MET	HB2	H	1.889	0.013	1
9	1	4	MET	HB3	H	1.889	0.013	1
10	1	4	MET	HG2	H	2.334	0.020	1
11	1	4	MET	HG3	H	2.334	0.020	1
12	1	4	MET	CA	C	52.166	0.020	1
13	1	4	MET	CB	C	32.422	0.030	1
14	1	4	MET	N	N	122.415	0.039	1
15	1	5	LYS	H	H	8.321	0.004	1
16	1	5	LYS	HA	H	4.895	0.026	1
17	1	5	LYS	HB2	H	1.529	0.027	2
18	1	5	LYS	HB3	H	1.532	0.028	2
19	1	5	LYS	HG2	H	1.231	0.007	2
20	1	5	LYS	HG3	H	1.148	0.015	2
21	1	5	LYS	HD2	H	1.447	0.001	1
22	1	5	LYS	HD3	H	1.447	0.001	1
23	1	5	LYS	HE2	H	2.765	0.004	1
24	1	5	LYS	HE3	H	2.765	0.004	1
25	1	5	LYS	CA	C	52.529	0.106	1
26	1	5	LYS	CB	C	30.447	0.018	1
27	1	5	LYS	N	N	123.489	0.066	1
28	1	6	LEU	H	H	8.843	0.008	1
29	1	6	LEU	HA	H	4.595	0.005	1
30	1	6	LEU	HB2	H	1.419	0.009	1
31	1	6	LEU	HB3	H	1.419	0.009	1
32	1	6	LEU	HG	H	1.263	0.010	1
33	1	6	LEU	HD11	H	0.666	0.004	2
34	1	6	LEU	HD12	H	0.666	0.004	2
35	1	6	LEU	HD13	H	0.666	0.004	2
36	1	6	LEU	HD21	H	0.681	0.003	2
37	1	6	LEU	HD22	H	0.681	0.003	2
38	1	6	LEU	HD23	H	0.681	0.003	2
39	1	6	LEU	CA	C	51.075	0.071	1
40	1	6	LEU	CB	C	42.472	0.028	1
41	1	6	LEU	N	N	125.748	0.063	1
42	1	7	SER	H	H	8.317	0.006	1
43	1	7	SER	HA	H	5.226	0.014	1
44	1	7	SER	HB2	H	3.568	0.000	2
45	1	7	SER	HB3	H	3.565	0.015	2
46	1	7	SER	CA	C	54.321	0.053	1
47	1	7	SER	CB	C	61.539	0.120	1
48	1	7	SER	N	N	117.316	0.045	1
49	1	8	VAL	H	H	8.833	0.005	1
50	1	8	VAL	HA	H	4.432	0.019	1
51	1	8	VAL	HB	H	1.890	0.007	1
52	1	8	VAL	HG11	H	0.693	0.002	1
53	1	8	VAL	HG12	H	0.693	0.002	1
54	1	8	VAL	HG13	H	0.693	0.002	1
55	1	8	VAL	HG21	H	0.693	0.002	1
56	1	8	VAL	HG22	H	0.693	0.002	1
57	1	8	VAL	HG23	H	0.693	0.002	1
58	1	8	VAL	CA	C	56.829	0.036	1
59	1	8	VAL	CB	C	32.369	0.031	1
60	1	8	VAL	N	N	122.044	0.060	1
61	1	9	SER	H	H	8.385	0.005	1
62	1	9	SER	HA	H	5.098	0.013	1
63	1	9	SER	HB2	H	3.562	0.007	2
64	1	9	SER	HB3	H	3.555	0.024	2
65	1	9	SER	CA	C	54.575	0.045	1
66	1	9	SER	CB	C	61.206	0.045	1
67	1	9	SER	N	N	120.578	0.051	1
68	1	10	LEU	H	H	8.562	0.007	1
69	1	10	LEU	HA	H	4.837	0.023	1
70	1	10	LEU	HB2	H	1.452	0.010	1
71	1	10	LEU	HB3	H	1.452	0.010	1
72	1	10	LEU	HG	H	0.792	0.016	1
73	1	10	LEU	HD11	H	0.623	0.007	2
74	1	10	LEU	HD12	H	0.623	0.007	2
75	1	10	LEU	HD13	H	0.623	0.007	2
76	1	10	LEU	HD21	H	0.745	0.000	2
77	1	10	LEU	HD22	H	0.745	0.000	2
78	1	10	LEU	HD23	H	0.745	0.000	2
79	1	10	LEU	CA	C	50.038	0.037	1
80	1	10	LEU	CB	C	43.926	0.016	1
81	1	10	LEU	N	N	124.964	0.047	1
82	1	11	SER	H	H	9.394	0.006	1
83	1	11	SER	HA	H	4.639	0.022	1
84	1	11	SER	HB2	H	3.917	0.019	1
85	1	11	SER	CA	C	54.681	0.019	1
86	1	11	SER	CB	C	62.647	0.013	1
87	1	11	SER	N	N	118.333	0.045	1
88	1	12	ASP	H	H	8.547	0.002	1
89	1	12	ASP	HA	H	4.151	0.021	1
90	1	12	ASP	HB2	H	2.553	0.019	2
91	1	12	ASP	HB3	H	2.362	0.000	2
92	1	12	ASP	CA	C	55.071	0.032	1
93	1	12	ASP	CB	C	37.165	0.010	1
94	1	12	ASP	N	N	121.318	0.082	1
95	1	13	ASP	H	H	8.199	0.003	1
96	1	13	ASP	HA	H	4.305	0.003	1
97	1	13	ASP	HB2	H	2.481	0.017	1
98	1	13	ASP	CA	C	54.455	0.024	1
99	1	13	ASP	CB	C	38.070	0.012	1
100	1	13	ASP	N	N	119.571	0.077	1
101	1	14	ASP	H	H	7.694	0.008	1
102	1	14	ASP	HA	H	4.301	0.023	1
103	1	14	ASP	HB2	H	2.948	0.006	1
104	1	14	ASP	HB3	H	2.948	0.006	1
105	1	14	ASP	CA	C	54.869	0.061	1
106	1	14	ASP	CB	C	38.628	0.079	1
107	1	14	ASP	N	N	121.009	0.126	1
108	1	15	VAL	H	H	8.168	0.009	1
109	1	15	VAL	HA	H	3.322	0.017	1
110	1	15	VAL	HB	H	1.981	0.004	1
111	1	15	VAL	HG11	H	0.809	0.020	2
112	1	15	VAL	HG12	H	0.809	0.020	2
113	1	15	VAL	HG13	H	0.809	0.020	2
114	1	15	VAL	HG21	H	0.880	0.022	2
115	1	15	VAL	HG22	H	0.880	0.022	2
116	1	15	VAL	HG23	H	0.880	0.022	2
117	1	15	VAL	CA	C	64.135	0.043	1
118	1	15	VAL	CB	C	28.696	0.013	1
119	1	15	VAL	N	N	119.722	0.065	1
120	1	16	ALA	H	H	7.747	0.003	1
121	1	16	ALA	HA	H	4.137	0.022	1
122	1	16	ALA	HB1	H	1.459	0.020	1
123	1	16	ALA	HB2	H	1.459	0.020	1
124	1	16	ALA	HB3	H	1.459	0.020	1
125	1	16	ALA	CA	C	52.633	0.041	1
126	1	16	ALA	CB	C	14.925	0.096	1
127	1	16	ALA	N	N	121.455	0.084	1
128	1	17	ILE	H	H	7.537	0.005	1
129	1	17	ILE	HA	H	3.587	0.017	1
130	1	17	ILE	HB	H	1.900	0.021	1
131	1	17	ILE	HG21	H	0.718	0.011	1
132	1	17	ILE	HG22	H	0.718	0.011	1
133	1	17	ILE	HG23	H	0.718	0.011	1
134	1	17	ILE	HD11	H	0.737	0.007	1
135	1	17	ILE	HD12	H	0.737	0.007	1
136	1	17	ILE	HD13	H	0.737	0.007	1
137	1	17	ILE	CA	C	62.229	0.065	1
138	1	17	ILE	CB	C	34.990	0.000	1
139	1	17	ILE	N	N	120.417	0.051	1
140	1	18	LEU	H	H	7.940	0.002	1
141	1	18	LEU	HA	H	4.026	0.003	1
142	1	18	LEU	HB2	H	1.278	0.014	1
143	1	18	LEU	CA	C	55.436	0.020	1
144	1	18	LEU	CB	C	39.557	0.089	1
145	1	18	LEU	N	N	122.505	0.025	1
146	1	19	ASP	H	H	9.233	0.004	1
147	1	19	ASP	HA	H	4.254	0.015	1
148	1	19	ASP	HB2	H	2.611	0.000	2
149	1	19	ASP	HB3	H	2.458	0.020	2
150	1	19	ASP	CA	C	54.576	0.065	1
151	1	19	ASP	CB	C	36.737	0.037	1
152	1	19	ASP	N	N	119.200	0.064	1
153	1	20	ALA	H	H	7.919	0.005	1
154	1	20	ALA	HA	H	4.106	0.024	1
155	1	20	ALA	HB1	H	1.472	0.019	1
156	1	20	ALA	HB2	H	1.472	0.019	1
157	1	20	ALA	HB3	H	1.472	0.019	1
158	1	20	ALA	CA	C	52.376	0.028	1
159	1	20	ALA	CB	C	15.019	0.056	1
160	1	20	ALA	N	N	123.637	0.087	1
161	1	21	TYR	H	H	8.136	0.006	1
162	1	21	TYR	HA	H	3.934	0.011	1
163	1	21	TYR	HB2	H	3.046	0.012	1
164	1	21	TYR	HD1	H	6.773	0.003	1
165	1	21	TYR	HD2	H	6.773	0.003	1
166	1	21	TYR	HE1	H	6.593	0.015	1
167	1	21	TYR	HE2	H	6.593	0.015	1
168	1	21	TYR	CA	C	59.599	0.068	1
169	1	21	TYR	CB	C	35.658	0.044	1
170	1	21	TYR	N	N	121.674	0.109	1
171	1	22	VAL	H	H	8.721	0.009	1
172	1	22	VAL	HA	H	3.295	0.014	1
173	1	22	VAL	HB	H	2.132	0.012	1
174	1	22	VAL	HG11	H	0.989	0.018	2
175	1	22	VAL	HG12	H	0.989	0.018	2
176	1	22	VAL	HG13	H	0.989	0.018	2
177	1	22	VAL	HG21	H	0.627	0.007	2
178	1	22	VAL	HG22	H	0.627	0.007	2
179	1	22	VAL	HG23	H	0.627	0.007	2
180	1	22	VAL	CA	C	64.461	0.062	1
181	1	22	VAL	CB	C	29.307	0.107	1
182	1	22	VAL	CG1	C	21.773	0.000	1
183	1	22	VAL	N	N	119.191	0.041	1
184	1	23	LYS	H	H	7.570	0.006	1
185	1	23	LYS	HA	H	4.012	0.008	1
186	1	23	LYS	HB2	H	1.780	0.007	1
187	1	23	LYS	HB3	H	1.780	0.007	1
188	1	23	LYS	HG2	H	1.329	0.005	2
189	1	23	LYS	HG3	H	1.176	0.016	2
190	1	23	LYS	HD2	H	1.568	0.000	1
191	1	23	LYS	HE2	H	3.054	0.000	1
192	1	23	LYS	CA	C	56.379	0.044	1
193	1	23	LYS	CB	C	29.835	0.034	1
194	1	23	LYS	N	N	117.132	0.075	1
195	1	24	ARG	H	H	7.919	0.004	1
196	1	24	ARG	HA	H	3.924	0.009	1
197	1	24	ARG	HB2	H	1.749	0.011	1
198	1	24	ARG	HG2	H	1.561	0.003	1
199	1	24	ARG	HD2	H	3.072	0.003	1
200	1	24	ARG	CA	C	56.385	0.035	1
201	1	24	ARG	CB	C	27.273	0.020	1
202	1	24	ARG	N	N	120.784	0.106	1
203	1	25	ALA	H	H	8.423	0.006	1
204	1	25	ALA	HA	H	4.070	0.024	1
205	1	25	ALA	HB1	H	0.796	0.016	1
206	1	25	ALA	HB2	H	0.796	0.016	1
207	1	25	ALA	HB3	H	0.796	0.016	1
208	1	25	ALA	CA	C	49.271	0.052	1
209	1	25	ALA	CB	C	15.744	0.042	1
210	1	25	ALA	N	N	118.897	0.055	1
211	1	26	GLY	H	H	7.434	0.004	1
212	1	26	GLY	HA2	H	3.779	0.009	1
213	1	26	GLY	HA3	H	3.779	0.009	1
214	1	26	GLY	CA	C	43.884	0.024	1
215	1	26	GLY	N	N	108.117	0.096	1
216	1	27	LEU	H	H	7.941	0.004	1
217	1	27	LEU	HA	H	4.448	0.015	1
218	1	27	LEU	HB2	H	1.764	0.000	1
219	1	27	LEU	HG	H	1.612	0.019	1
220	1	27	LEU	HD11	H	0.333	0.017	2
221	1	27	LEU	HD12	H	0.333	0.017	2
222	1	27	LEU	HD13	H	0.333	0.017	2
223	1	27	LEU	HD21	H	0.634	0.013	2
224	1	27	LEU	HD22	H	0.634	0.013	2
225	1	27	LEU	HD23	H	0.634	0.013	2
226	1	27	LEU	CA	C	49.558	0.091	1
227	1	27	LEU	CB	C	39.588	0.000	1
228	1	27	LEU	N	N	118.612	0.113	1
229	1	28	PRO	HA	H	4.357	0.027	1
230	1	28	PRO	HB2	H	1.974	0.000	1
231	1	28	PRO	HG2	H	1.805	0.005	1
232	1	28	PRO	HD2	H	3.654	0.028	2
233	1	28	PRO	HD3	H	3.355	0.049	2
234	1	28	PRO	CA	C	61.393	0.046	1
235	1	28	PRO	CB	C	29.762	0.005	1
236	1	29	SER	H	H	6.735	0.007	1
237	1	29	SER	HA	H	4.708	0.006	1
238	1	29	SER	HB2	H	3.862	0.016	1
239	1	29	SER	CA	C	53.818	0.087	1
240	1	29	SER	CB	C	63.593	0.031	1
241	1	29	SER	N	N	108.734	0.056	1
242	1	30	ARG	H	H	9.064	0.007	1
243	1	30	ARG	HA	H	3.956	0.015	1
244	1	30	ARG	HG2	H	1.516	0.000	1
245	1	30	ARG	HD2	H	3.142	0.000	1
246	1	30	ARG	HE	H	9.803	0.000	1
247	1	30	ARG	CA	C	57.895	0.000	1
248	1	30	ARG	CB	C	28.190	0.000	1
249	1	30	ARG	N	N	119.948	0.054	1
250	1	30	ARG	NE	N	85.146	0.002	1
251	1	31	SER	H	H	8.393	0.004	1
252	1	31	SER	HA	H	4.187	0.002	1
253	1	31	SER	HB2	H	3.901	0.000	1
254	1	31	SER	N	N	114.964	0.057	1
255	1	33	GLY	H	H	7.587	0.005	1
256	1	33	GLY	HA2	H	3.619	0.011	1
257	1	33	GLY	CA	C	44.900	0.006	1
258	1	33	GLY	N	N	104.105	0.142	1
259	1	34	LEU	H	H	8.028	0.007	1
260	1	34	LEU	HA	H	4.047	0.000	1
261	1	34	LEU	HB2	H	1.355	0.000	1
262	1	34	LEU	HG	H	1.269	0.000	1
263	1	34	LEU	HD11	H	0.696	0.001	1
264	1	34	LEU	HD12	H	0.696	0.001	1
265	1	34	LEU	HD13	H	0.696	0.001	1
266	1	34	LEU	N	N	121.409	0.154	1
267	1	35	GLN	H	H	8.008	0.008	1
268	1	35	GLN	HA	H	3.742	0.000	1
269	1	35	GLN	HG2	H	2.529	0.003	2
270	1	35	GLN	HG3	H	2.310	0.016	2
271	1	35	GLN	HE21	H	7.900	0.004	1
272	1	35	GLN	HE22	H	6.783	0.004	1
273	1	35	GLN	CA	C	57.218	0.000	1
274	1	35	GLN	CB	C	25.469	0.000	1
275	1	35	GLN	N	N	118.207	0.080	1
276	1	35	GLN	NE2	N	112.235	0.075	1
277	1	42	ARG	CA	C	56.053	0.000	1
278	1	46	LEU	CA	C	52.185	0.000	1
279	1	46	LEU	CB	C	40.083	0.000	1
280	1	50	TYR	H	H	7.789	0.010	1
281	1	50	TYR	N	N	120.073	0.012	1
282	1	51	ALA	H	H	8.032	0.004	1
283	1	51	ALA	HA	H	4.023	0.000	1
284	1	51	ALA	HB1	H	1.281	0.001	1
285	1	51	ALA	HB2	H	1.281	0.001	1
286	1	51	ALA	HB3	H	1.281	0.001	1
287	1	51	ALA	N	N	122.963	0.067	1
288	1	52	ASN	H	H	8.072	0.009	1
289	1	52	ASN	HA	H	4.482	0.003	1
290	1	52	ASN	HB2	H	2.644	0.001	1
291	1	52	ASN	HB3	H	2.644	0.001	1
292	1	52	ASN	HD21	H	7.645	0.001	1
293	1	52	ASN	HD22	H	6.845	0.000	1
294	1	52	ASN	N	N	116.491	0.065	1
295	1	52	ASN	ND2	N	113.372	0.003	1
296	1	53	ALA	H	H	7.920	0.000	1
297	1	53	ALA	N	N	123.620	0.005	1
298	1	54	TRP	H	H	7.902	0.003	1
299	1	54	TRP	HA	H	4.262	0.008	1
300	1	54	TRP	HB2	H	3.158	0.005	2
301	1	54	TRP	HB3	H	3.161	0.000	2
302	1	54	TRP	HE1	H	9.921	0.001	1
303	1	54	TRP	N	N	118.485	0.074	1
304	1	54	TRP	NE1	N	128.674	0.026	1
305	1	55	GLN	H	H	7.728	0.003	1
306	1	55	GLN	HA	H	3.957	0.004	1
307	1	55	GLN	HB2	H	1.845	0.000	1
308	1	55	GLN	HB3	H	1.845	0.000	1
309	1	55	GLN	HG2	H	2.084	0.000	1
310	1	55	GLN	HG3	H	2.084	0.000	1
311	1	55	GLN	HE21	H	7.281	0.000	1
312	1	55	GLN	HE22	H	6.718	0.000	1
313	1	55	GLN	N	N	120.677	0.071	1
314	1	55	GLN	NE2	N	111.326	0.025	1
315	1	57	TRP	H	H	8.029	0.003	1
316	1	57	TRP	HA	H	4.275	0.000	1
317	1	57	TRP	HB2	H	3.138	0.000	1
318	1	57	TRP	HB3	H	3.138	0.000	1
319	1	57	TRP	HE1	H	9.877	0.002	1
320	1	57	TRP	N	N	121.454	0.096	1
321	1	57	TRP	NE1	N	129.043	0.002	1
322	1	58	SER	H	H	7.951	0.008	1
323	1	58	SER	N	N	116.246	0.040	1
324	1	61	GLY	H	H	7.963	0.003	1
325	1	61	GLY	HA2	H	3.776	0.000	1
326	1	61	GLY	CA	C	42.545	0.001	1
327	1	61	GLY	N	N	107.124	0.004	1
328	1	62	ASP	H	H	8.129	0.015	1
329	1	62	ASP	HA	H	4.555	0.023	1
330	1	62	ASP	HB2	H	2.640	0.000	1
331	1	62	ASP	CA	C	51.595	0.004	1
332	1	62	ASP	CB	C	38.408	0.004	1
333	1	62	ASP	N	N	120.552	0.010	1
334	1	63	THR	H	H	8.016	0.002	1
335	1	63	THR	HA	H	4.156	0.014	1
336	1	63	THR	HB	H	4.359	0.018	1
337	1	63	THR	HG21	H	1.053	0.013	1
338	1	63	THR	HG22	H	1.053	0.013	1
339	1	63	THR	HG23	H	1.053	0.013	1
340	1	63	THR	CA	C	59.455	0.018	1
341	1	63	THR	CB	C	67.038	0.072	1
342	1	63	THR	N	N	113.857	0.058	1
343	1	64	ASP	H	H	8.251	0.003	1
344	1	64	ASP	HA	H	4.480	0.020	1
345	1	64	ASP	HB2	H	2.510	0.007	2
346	1	64	ASP	HB3	H	2.494	0.019	2
347	1	64	ASP	CA	C	52.017	0.051	1
348	1	64	ASP	CB	C	38.377	0.030	1
349	1	64	ASP	N	N	122.587	0.045	1
350	1	65	ALA	H	H	8.003	0.003	1
351	1	65	ALA	HA	H	4.173	0.021	1
352	1	65	ALA	HB1	H	1.201	0.022	1
353	1	65	ALA	HB2	H	1.201	0.022	1
354	1	65	ALA	HB3	H	1.201	0.022	1
355	1	65	ALA	CA	C	49.984	0.019	1
356	1	65	ALA	CB	C	16.282	0.034	1
357	1	65	ALA	N	N	123.715	0.040	1
358	1	66	TRP	H	H	7.958	0.003	1
359	1	66	TRP	HA	H	4.516	0.019	1
360	1	66	TRP	HB2	H	3.187	0.009	2
361	1	66	TRP	HB3	H	3.505	0.000	2
362	1	66	TRP	HD1	H	7.166	0.003	1
363	1	66	TRP	HE1	H	10.030	0.002	1
364	1	66	TRP	HZ2	H	7.345	0.000	1
365	1	66	TRP	CA	C	54.806	0.052	1
366	1	66	TRP	CB	C	26.753	0.049	1
367	1	66	TRP	N	N	120.042	0.061	1
368	1	66	TRP	NE1	N	129.376	0.063	1
369	1	67	GLU	H	H	8.067	0.001	1
370	1	67	GLU	HA	H	4.043	0.021	1
371	1	67	GLU	HB2	H	1.874	0.000	2
372	1	67	GLU	HB3	H	1.745	0.000	2
373	1	67	GLU	HG2	H	2.005	0.000	1
374	1	67	GLU	HG3	H	2.005	0.000	1
375	1	67	GLU	CA	C	53.914	0.009	1
376	1	67	GLU	CB	C	27.540	0.054	1
377	1	67	GLU	N	N	122.143	0.035	1
378	1	68	GLN	H	H	8.124	0.001	1
379	1	68	GLN	HA	H	4.200	0.021	1
380	1	68	GLN	HB2	H	1.987	0.024	2
381	1	68	GLN	HB3	H	1.877	0.010	2
382	1	68	GLN	HG2	H	2.237	0.004	2
383	1	68	GLN	HG3	H	2.241	0.000	2
384	1	68	GLN	HE21	H	7.443	0.001	1
385	1	68	GLN	HE22	H	6.760	0.002	1
386	1	68	GLN	CA	C	53.171	0.026	1
387	1	68	GLN	CB	C	26.678	0.026	1
388	1	68	GLN	CG	C	31.017	0.003	1
389	1	68	GLN	N	N	121.003	0.037	1
390	1	68	GLN	NE2	N	111.909	0.050	1
391	1	69	THR	H	H	8.150	0.006	1
392	1	69	THR	HA	H	4.257	0.016	1
393	1	69	THR	HB	H	4.099	0.012	1
394	1	69	THR	HG21	H	1.100	0.003	1
395	1	69	THR	HG22	H	1.100	0.003	1
396	1	69	THR	HG23	H	1.100	0.003	1
397	1	69	THR	CA	C	59.330	0.031	1
398	1	69	THR	CB	C	67.149	0.084	1
399	1	69	THR	N	N	116.216	0.033	1
400	1	70	VAL	H	H	8.116	0.004	1
401	1	70	VAL	HA	H	4.042	0.020	1
402	1	70	VAL	HB	H	1.959	0.023	1
403	1	70	VAL	HG11	H	0.839	0.000	1
404	1	70	VAL	HG12	H	0.839	0.000	1
405	1	70	VAL	HG13	H	0.839	0.000	1
406	1	70	VAL	HG21	H	0.839	0.000	1
407	1	70	VAL	HG22	H	0.839	0.000	1
408	1	70	VAL	HG23	H	0.839	0.000	1
409	1	70	VAL	CA	C	59.670	0.051	1
410	1	70	VAL	CB	C	30.054	0.019	1
411	1	70	VAL	N	N	122.394	0.038	1
412	1	71	GLY	H	H	8.324	0.002	1
413	1	71	GLY	HA2	H	3.891	0.002	1
414	1	71	GLY	HA3	H	3.891	0.002	1
415	1	71	GLY	CA	C	42.504	0.003	1
416	1	71	GLY	N	N	112.374	0.039	1
417	1	72	ASP	H	H	8.216	0.000	1
418	1	72	ASP	CA	C	51.703	0.015	1
419	1	72	ASP	CB	C	38.510	0.020	1
420	1	72	ASP	N	N	120.407	0.036	1
421	1	73	GLY	H	H	8.392	0.001	1
422	1	73	GLY	HA2	H	3.878	0.001	1
423	1	73	GLY	HA3	H	3.878	0.001	1
424	1	73	GLY	CA	C	42.732	0.012	1
425	1	73	GLY	N	N	109.372	0.035	1
426	1	74	VAL	H	H	7.943	0.001	1
427	1	74	VAL	HA	H	4.022	0.024	1
428	1	74	VAL	HB	H	2.037	0.000	1
429	1	74	VAL	HG11	H	0.834	0.003	2
430	1	74	VAL	HG12	H	0.834	0.003	2
431	1	74	VAL	HG13	H	0.834	0.003	2
432	1	74	VAL	HG21	H	0.838	0.000	2
433	1	74	VAL	HG22	H	0.838	0.000	2
434	1	74	VAL	HG23	H	0.838	0.000	2
435	1	74	VAL	CA	C	59.983	0.056	1
436	1	74	VAL	CB	C	29.748	0.048	1
437	1	74	VAL	N	N	119.211	0.083	1
438	1	75	GLY	H	H	8.432	0.001	1
439	1	75	GLY	HA2	H	3.879	0.000	1
440	1	75	GLY	HA3	H	3.879	0.000	1
441	1	75	GLY	CA	C	42.523	0.006	1
442	1	75	GLY	N	N	112.158	0.032	1
443	1	76	ASP	H	H	8.095	0.006	1
444	1	76	ASP	CA	C	51.283	0.036	1
445	1	76	ASP	CB	C	38.541	0.005	1
446	1	76	ASP	N	N	120.482	0.023	1
447	1	77	ALA	H	H	8.063	0.001	1
448	1	77	ALA	HA	H	4.474	0.022	1
449	1	77	ALA	HB1	H	1.256	0.022	1
450	1	77	ALA	HB2	H	1.256	0.022	1
451	1	77	ALA	HB3	H	1.256	0.022	1
452	1	77	ALA	CA	C	47.860	0.033	1
453	1	77	ALA	CB	C	15.490	0.021	1
454	1	77	ALA	N	N	125.216	0.032	1
455	1	78	PRO	HA	H	4.295	0.017	1
456	1	78	PRO	CA	C	60.612	0.028	1
457	1	78	PRO	CB	C	29.146	0.000	1
458	1	79	ARG	H	H	7.935	0.002	1
459	1	79	ARG	HA	H	4.081	0.022	1
460	1	79	ARG	HB2	H	1.786	0.021	2
461	1	79	ARG	HB3	H	1.741	0.024	2
462	1	79	ARG	HG2	H	1.617	0.007	2
463	1	79	ARG	HG3	H	1.542	0.000	2
464	1	79	ARG	HD2	H	3.098	0.000	1
465	1	79	ARG	HD3	H	3.098	0.000	1
466	1	79	ARG	CA	C	54.598	0.051	1
467	1	79	ARG	CB	C	28.869	0.010	1
468	1	79	ARG	N	N	126.639	0.050	1

Chemical Shifts 2

¹H: 68, ¹³C: 159, ¹⁵N: 64 assignments Detail

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
469	1	2	GLY	CA	C	45.226	0.014	1
470	1	3	SER	H	H	8.086	0.003	1
471	1	3	SER	CA	C	57.781	0.025	1
472	1	3	SER	CB	C	64.883	0.020	1
473	1	3	SER	N	N	115.040	0.016	1
474	1	4	MET	H	H	8.835	0.002	1
475	1	4	MET	CA	C	54.899	0.126	1
476	1	4	MET	CB	C	35.074	0.048	1
477	1	4	MET	CG	C	31.526	0.000	1
478	1	4	MET	N	N	122.325	0.015	1
479	1	5	LYS	H	H	8.278	0.003	1
480	1	5	LYS	CA	C	55.205	0.021	1
481	1	5	LYS	CB	C	33.189	0.023	1
482	1	5	LYS	CG	C	24.799	0.000	1
483	1	5	LYS	CD	C	29.195	0.000	1
484	1	5	LYS	CE	C	41.908	0.000	1
485	1	5	LYS	N	N	123.461	0.011	1
486	1	6	LEU	H	H	8.807	0.003	1
487	1	6	LEU	CA	C	53.838	0.003	1
488	1	6	LEU	CB	C	45.180	0.025	1
489	1	6	LEU	CG	C	27.278	0.000	1
490	1	6	LEU	CD1	C	25.557	0.000	1
491	1	6	LEU	CD2	C	25.557	0.000	1
492	1	6	LEU	N	N	125.585	0.030	1
493	1	7	SER	H	H	8.273	0.003	1
494	1	7	SER	CA	C	56.978	0.023	1
495	1	7	SER	CB	C	64.149	0.021	1
496	1	7	SER	N	N	117.231	0.034	1
497	1	8	VAL	H	H	8.802	0.003	1
498	1	8	VAL	CA	C	59.528	0.043	1
499	1	8	VAL	CB	C	35.059	0.016	1
500	1	8	VAL	CG1	C	20.556	0.000	1
501	1	8	VAL	N	N	121.850	0.020	1
502	1	9	SER	H	H	8.343	0.003	1
503	1	9	SER	CA	C	57.189	0.047	1
504	1	9	SER	CB	C	63.826	0.024	1
505	1	9	SER	N	N	120.462	0.032	1
506	1	10	LEU	H	H	8.532	0.003	1
507	1	10	LEU	CA	C	52.796	0.014	1
508	1	10	LEU	CB	C	46.552	0.097	1
509	1	10	LEU	CG	C	26.769	0.000	1
510	1	10	LEU	CD1	C	23.735	0.000	1
511	1	10	LEU	N	N	124.821	0.021	1
512	1	11	SER	H	H	9.360	0.004	1
513	1	11	SER	CA	C	57.274	0.012	1
514	1	11	SER	CB	C	65.286	0.009	1
515	1	11	SER	N	N	118.230	0.020	1
516	1	12	ASP	H	H	8.531	0.003	1
517	1	12	ASP	CA	C	57.632	0.051	1
518	1	12	ASP	CB	C	39.987	0.032	1
519	1	12	ASP	N	N	121.230	0.007	1
520	1	13	ASP	H	H	8.167	0.003	1
521	1	13	ASP	CA	C	57.133	0.054	1
522	1	13	ASP	CB	C	40.739	0.015	1
523	1	13	ASP	N	N	119.400	0.010	1
524	1	14	ASP	H	H	7.648	0.002	1
525	1	14	ASP	CA	C	57.382	0.012	1
526	1	14	ASP	CB	C	41.435	0.015	1
527	1	14	ASP	N	N	120.778	0.043	1
528	1	15	VAL	H	H	8.131	0.004	1
529	1	15	VAL	CA	C	66.741	0.044	1
530	1	15	VAL	CB	C	31.483	0.043	1
531	1	15	VAL	N	N	119.527	0.059	1
532	1	16	ALA	H	H	7.728	0.004	1
533	1	16	ALA	CA	C	55.359	0.011	1
534	1	16	ALA	CB	C	17.695	0.046	1
535	1	16	ALA	N	N	121.390	0.014	1
536	1	17	ILE	H	H	7.510	0.003	1
537	1	17	ILE	CA	C	64.634	0.059	1
538	1	17	ILE	CB	C	37.752	0.026	1
539	1	17	ILE	CG2	C	18.222	0.000	1
540	1	17	ILE	CD1	C	13.186	0.000	1
541	1	17	ILE	N	N	120.186	0.012	1
542	1	18	LEU	H	H	7.918	0.005	1
543	1	18	LEU	CA	C	58.103	0.054	1
544	1	18	LEU	CB	C	42.266	0.022	1
545	1	18	LEU	CG	C	27.226	0.000	1
546	1	18	LEU	CD1	C	25.862	0.000	2
547	1	18	LEU	CD2	C	22.539	0.000	2
548	1	18	LEU	N	N	122.352	0.045	1
549	1	19	ASP	H	H	9.205	0.006	1
550	1	19	ASP	CA	C	57.327	0.084	1
551	1	19	ASP	CB	C	39.470	0.009	1
552	1	19	ASP	N	N	119.129	0.035	1
553	1	20	ALA	H	H	7.886	0.002	1
554	1	20	ALA	CA	C	55.000	0.019	1
555	1	20	ALA	CB	C	17.826	0.025	1
556	1	20	ALA	N	N	123.455	0.021	1
557	1	21	TYR	H	H	8.126	0.004	1
558	1	21	TYR	CA	C	62.191	0.032	1
559	1	21	TYR	CB	C	38.404	0.017	1
560	1	21	TYR	N	N	121.518	0.031	1
561	1	22	VAL	H	H	8.708	0.008	1
562	1	22	VAL	CA	C	67.022	0.047	1
563	1	22	VAL	CB	C	32.019	0.000	1
564	1	22	VAL	N	N	119.070	0.037	1
565	1	23	LYS	H	H	7.564	0.004	1
566	1	23	LYS	CA	C	58.927	0.012	1
567	1	23	LYS	CB	C	32.538	0.057	1
568	1	23	LYS	CG	C	24.749	0.000	1
569	1	23	LYS	CD	C	29.241	0.000	1
570	1	23	LYS	CE	C	42.071	0.000	1
571	1	23	LYS	N	N	117.129	0.006	1
572	1	24	ARG	H	H	7.891	0.004	1
573	1	24	ARG	CA	C	58.923	0.031	1
574	1	24	ARG	CB	C	30.054	0.010	1
575	1	24	ARG	CG	C	27.172	0.000	1
576	1	24	ARG	CD	C	43.498	0.000	1
577	1	24	ARG	N	N	120.675	0.020	1
578	1	25	ALA	H	H	8.391	0.003	1
579	1	25	ALA	CA	C	51.877	0.040	1
580	1	25	ALA	CB	C	18.486	0.022	1
581	1	25	ALA	N	N	118.801	0.017	1
582	1	26	GLY	H	H	7.422	0.004	1
583	1	26	GLY	CA	C	46.553	0.023	1
584	1	26	GLY	N	N	107.990	0.011	1
585	1	27	LEU	H	H	7.907	0.003	1
586	1	27	LEU	CA	C	52.349	0.000	1
587	1	27	LEU	CB	C	42.389	0.000	1
588	1	27	LEU	N	N	118.510	0.018	1
589	1	29	SER	H	H	6.726	0.005	1
590	1	29	SER	CA	C	56.563	0.000	1
591	1	29	SER	CB	C	66.182	0.000	1
592	1	29	SER	N	N	108.516	0.007	1
593	1	30	ARG	HE	H	9.802	0.004	1
594	1	30	ARG	CG	C	28.708	0.000	1
595	1	30	ARG	CD	C	43.757	0.012	1
596	1	30	ARG	NE	N	85.180	0.000	1
597	1	31	SER	H	H	8.364	0.001	1
598	1	31	SER	CB	C	63.205	0.000	1
599	1	31	SER	N	N	114.818	0.011	1
600	1	33	GLY	H	H	7.581	0.003	1
601	1	33	GLY	CA	C	47.539	0.031	1
602	1	33	GLY	N	N	103.874	0.017	1
603	1	34	LEU	H	H	8.014	0.010	1
604	1	34	LEU	CA	C	57.394	0.035	1
605	1	34	LEU	CB	C	41.703	0.093	1
606	1	34	LEU	CG	C	26.986	0.000	1
607	1	34	LEU	CD1	C	25.764	0.000	2
608	1	34	LEU	CD2	C	24.351	0.000	2
609	1	34	LEU	N	N	121.435	0.014	1
610	1	35	GLN	H	H	7.972	0.004	1
611	1	35	GLN	HE21	H	7.874	0.000	1
612	1	35	GLN	HE22	H	6.716	0.000	1
613	1	35	GLN	CA	C	59.827	0.054	1
614	1	35	GLN	CB	C	28.168	0.000	1
615	1	35	GLN	CG	C	34.559	0.000	1
616	1	35	GLN	N	N	118.072	0.056	1
617	1	35	GLN	NE2	N	112.169	0.025	1
618	1	42	ARG	CA	C	58.719	0.000	1
619	1	42	ARG	CB	C	30.142	0.000	1
620	1	42	ARG	CG	C	27.241	0.000	1
621	1	42	ARG	CD	C	43.512	0.000	1
622	1	45	THR	CA	C	61.875	0.000	1
623	1	46	LEU	CA	C	55.119	0.197	1
624	1	46	LEU	CB	C	42.643	0.007	1
625	1	46	LEU	CG	C	26.865	0.000	1
626	1	46	LEU	CD1	C	25.246	0.000	2
627	1	46	LEU	CD2	C	23.362	0.000	2
628	1	49	ASP	CA	C	54.633	0.075	1
629	1	49	ASP	CB	C	41.051	0.102	1
630	1	50	TYR	H	H	7.792	0.005	1
631	1	50	TYR	CA	C	58.604	0.022	1
632	1	50	TYR	CB	C	37.834	0.074	1
633	1	50	TYR	N	N	119.953	0.024	1
634	1	51	ALA	H	H	7.985	0.003	1
635	1	51	ALA	CA	C	53.714	0.000	1
636	1	51	ALA	CB	C	18.617	0.172	1
637	1	51	ALA	N	N	122.885	0.026	1
638	1	52	ASN	H	H	8.018	0.006	1
639	1	52	ASN	HD21	H	7.591	0.000	1
640	1	52	ASN	HD22	H	6.800	0.000	1
641	1	52	ASN	CA	C	54.127	0.002	1
642	1	52	ASN	CB	C	38.782	0.094	1
643	1	52	ASN	N	N	116.308	0.015	1
644	1	52	ASN	ND2	N	113.145	0.001	1
645	1	53	ALA	H	H	7.917	0.004	1
646	1	53	ALA	CA	C	53.722	0.062	1
647	1	53	ALA	CB	C	18.647	0.010	1
648	1	53	ALA	N	N	123.486	0.026	1
649	1	54	TRP	H	H	7.855	0.004	1
650	1	54	TRP	HE1	H	9.906	0.000	1
651	1	54	TRP	CA	C	58.519	0.000	1
652	1	54	TRP	CB	C	29.176	0.098	1
653	1	54	TRP	N	N	118.316	0.064	1
654	1	54	TRP	NE1	N	128.579	0.000	1
655	1	55	GLN	H	H	7.709	0.003	1
656	1	55	GLN	HE21	H	7.239	0.004	1
657	1	55	GLN	HE22	H	6.681	0.004	1
658	1	55	GLN	CA	C	57.106	0.000	1
659	1	55	GLN	CB	C	28.955	0.079	1
660	1	55	GLN	CG	C	33.494	0.102	1
661	1	55	GLN	N	N	120.520	0.045	1
662	1	55	GLN	NE2	N	111.083	0.034	1
663	1	57	TRP	H	H	7.978	0.003	1
664	1	57	TRP	HE1	H	9.861	0.000	1
665	1	57	TRP	CA	C	57.729	0.000	1
666	1	57	TRP	CB	C	29.597	0.042	1
667	1	57	TRP	N	N	121.230	0.040	1
668	1	57	TRP	NE1	N	128.930	0.000	1
669	1	58	SER	H	H	7.906	0.003	1
670	1	58	SER	CA	C	58.444	0.000	1
671	1	58	SER	CB	C	63.607	0.000	1
672	1	58	SER	N	N	116.171	0.027	1
673	1	59	ALA	CA	C	52.621	0.000	1
674	1	59	ALA	CB	C	19.066	0.000	1
675	1	61	GLY	H	H	7.944	0.003	1
676	1	61	GLY	CA	C	45.297	0.000	1
677	1	61	GLY	N	N	107.060	0.014	1
678	1	62	ASP	H	H	8.098	0.000	1
679	1	62	ASP	CA	C	54.276	0.020	1
680	1	62	ASP	CB	C	41.160	0.010	1
681	1	62	ASP	N	N	120.381	0.021	1
682	1	63	THR	H	H	7.982	0.002	1
683	1	63	THR	CA	C	62.091	0.033	1
684	1	63	THR	CB	C	69.658	0.014	1
685	1	63	THR	CG2	C	21.456	0.000	1
686	1	63	THR	N	N	113.665	0.011	1
687	1	64	ASP	H	H	8.215	0.002	1
688	1	64	ASP	CA	C	54.621	0.017	1
689	1	64	ASP	CB	C	41.100	0.017	1
690	1	64	ASP	N	N	122.483	0.005	1
691	1	65	ALA	H	H	7.964	0.002	1
692	1	65	ALA	CA	C	52.673	0.036	1
693	1	65	ALA	CB	C	19.031	0.022	1
694	1	65	ALA	N	N	123.595	0.008	1
695	1	66	TRP	H	H	7.919	0.003	1
696	1	66	TRP	HE1	H	9.997	0.000	1
697	1	66	TRP	CA	C	57.324	0.061	1
698	1	66	TRP	CB	C	29.466	0.019	1
699	1	66	TRP	N	N	119.941	0.017	1
700	1	66	TRP	NE1	N	129.232	0.000	1
701	1	67	GLU	H	H	8.042	0.005	1
702	1	67	GLU	CA	C	56.646	0.045	1
703	1	67	GLU	CB	C	30.429	0.063	1
704	1	67	GLU	CG	C	36.090	0.000	1
705	1	67	GLU	N	N	121.976	0.019	1
706	1	68	GLN	H	H	8.085	0.002	1
707	1	68	GLN	HE21	H	7.404	0.004	1
708	1	68	GLN	HE22	H	6.718	0.003	1
709	1	68	GLN	CA	C	55.861	0.023	1
710	1	68	GLN	CB	C	29.420	0.038	1
711	1	68	GLN	CG	C	33.749	0.023	1
712	1	68	GLN	N	N	120.812	0.046	1
713	1	68	GLN	NE2	N	111.702	0.051	1
714	1	69	THR	H	H	8.106	0.002	1
715	1	69	THR	CA	C	61.908	0.016	1
716	1	69	THR	CB	C	69.807	0.006	1
717	1	69	THR	CG2	C	21.623	0.000	1
718	1	69	THR	N	N	115.963	0.010	1
719	1	70	VAL	H	H	8.063	0.002	1
720	1	70	VAL	CA	C	62.304	0.050	1
721	1	70	VAL	CB	C	32.810	0.010	1
722	1	70	VAL	CG1	C	20.678	0.000	2
723	1	70	VAL	CG2	C	20.937	0.000	2
724	1	70	VAL	N	N	122.166	0.014	1
725	1	71	GLY	H	H	8.275	0.002	1
726	1	71	GLY	CA	C	45.154	0.011	1
727	1	71	GLY	N	N	112.160	0.013	1
728	1	72	ASP	H	H	8.176	0.003	1
729	1	72	ASP	CA	C	54.379	0.018	1
730	1	72	ASP	CB	C	41.253	0.023	1
731	1	72	ASP	N	N	120.359	0.007	1
732	1	73	GLY	H	H	8.349	0.003	1
733	1	73	GLY	CA	C	45.467	0.024	1
734	1	73	GLY	N	N	109.237	0.004	1
735	1	74	VAL	H	H	7.899	0.002	1
736	1	74	VAL	CA	C	62.575	0.023	1
737	1	74	VAL	CB	C	32.503	0.044	1
738	1	74	VAL	CG1	C	21.023	0.000	2
739	1	74	VAL	CG2	C	20.613	0.000	2
740	1	74	VAL	N	N	119.035	0.007	1
741	1	75	GLY	H	H	8.384	0.002	1
742	1	75	GLY	CA	C	45.204	0.018	1
743	1	75	GLY	N	N	111.998	0.009	1
744	1	76	ASP	H	H	8.062	0.003	1
745	1	76	ASP	CA	C	54.029	0.043	1
746	1	76	ASP	CB	C	41.285	0.024	1
747	1	76	ASP	N	N	120.411	0.007	1
748	1	77	ALA	H	H	8.016	0.002	1
749	1	77	ALA	CA	C	50.473	0.000	1
750	1	77	ALA	CB	C	18.234	0.000	1
751	1	77	ALA	N	N	125.076	0.007	1
752	1	78	PRO	CA	C	63.229	0.005	1
753	1	78	PRO	CB	C	31.914	0.000	1
754	1	78	PRO	CG	C	27.328	0.000	1
755	1	78	PRO	CD	C	50.427	0.000	1
756	1	79	ARG	H	H	7.877	0.002	1
757	1	79	ARG	CA	C	57.232	0.000	1
758	1	79	ARG	CB	C	31.675	0.000	1
759	1	79	ARG	N	N	126.468	0.014	1

Release date

2023-02-26

Citation

Insights into the solution structure and transcriptional regulation of the MazE9 antitoxin in Mycobacterium tuberculosis
Basu Roy, T., Sarma, S.
Proteins (2023), PubMed 37737533 , DOI 10.1002/prot.26589 , Abstract

Entries sharing articles BMRB: 3 entries Detail

  BMRB: 51857 released on 2023-02-26
    Title Backbone and side-chain chemical shift assignments of the MazE9 antitoxin in Mycobacterium tuberculosis
  BMRB: 51855 released on 2023-02-22
    Title Backbone and side-chain chemical shift assignments of the N terminal domain of the MazE9 (nMazE9) antitoxin in Mycobacterium tuberculosis
  BMRB: 51850 released on 2023-02-20
    Title Backbone and side-chain chemical shift assignments of the conformers of the C terminal domain (CTD) of MazE9 antitoxin in Mycobacterium tuberculosis

Related entities 1. MazE9 P44A, : 2 : 3 entities Detail

Experiments performed 11 experiments Detail

1 2D 1H-15N HSQC