BMRB: 34776

Spider toxin Pha1b (PnTx3-6) from Phoneutria nigriventer targeting CaV2.x calcium channels and TRPA1 channel

Authors

Mironov, P.A., Chernaya, E.M., Paramonov, A.S., Shenkarev, Z.O.

Assembly

Omega-ctenitoxin-Pn4a

Entity

1. Omega-ctenitoxin-Pn4a (polymer, Thiol state: all disulfide bound), 55 monomers, 6045.006 Da Detail

ACIPRGEICT DDCECCGCDN QCYCPPGSSL GIFKCSCAHA NKYFCNRKKE KCKKA

Formula weight

6045.006 Da

Entity Connection

disulfide 6 Detail

---

ID	Type	Value order	Atom ID 1	Atom ID 2
1	disulfide	sing	1:CYS2:SG	1:CYS16:SG
2	disulfide	sing	1:CYS9:SG	1:CYS22:SG
3	disulfide	sing	1:CYS13:SG	1:CYS52:SG
4	disulfide	sing	1:CYS15:SG	1:CYS37:SG
5	disulfide	sing	1:CYS18:SG	1:CYS45:SG
6	disulfide	sing	1:CYS24:SG	1:CYS35:SG

Source organism

Phoneutria nigriventer

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 335, ¹³C: 145, ¹⁵N: 57 assignments Detail

Download

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• TSV

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	1	ALA	HA	H	4.141	0.020	1
2	1	1	ALA	HB1	H	1.533	0.020	1
3	1	1	ALA	HB2	H	1.533	0.020	1
4	1	1	ALA	HB3	H	1.533	0.020	1
5	1	1	ALA	CA	C	51.766	0.400	1
6	1	1	ALA	CB	C	19.566	0.400	1
7	1	2	CYS	H	H	8.427	0.020	1
8	1	2	CYS	HA	H	4.983	0.020	1
9	1	2	CYS	HB2	H	3.240	0.020	2
10	1	2	CYS	HB3	H	3.126	0.020	2
11	1	2	CYS	CA	C	54.752	0.400	1
12	1	2	CYS	CB	C	42.692	0.400	1
13	1	2	CYS	N	N	116.654	0.400	1
14	1	3	ILE	H	H	9.304	0.020	1
15	1	3	ILE	HA	H	4.427	0.020	1
16	1	3	ILE	HB	H	1.731	0.020	1
17	1	3	ILE	HG12	H	1.188	0.020	2
18	1	3	ILE	HG13	H	1.595	0.020	2
19	1	3	ILE	HG21	H	0.969	0.020	1
20	1	3	ILE	HG22	H	0.969	0.020	1
21	1	3	ILE	HG23	H	0.969	0.020	1
22	1	3	ILE	HD11	H	0.901	0.020	1
23	1	3	ILE	HD12	H	0.901	0.020	1
24	1	3	ILE	HD13	H	0.901	0.020	1
25	1	3	ILE	CA	C	58.674	0.400	1
26	1	3	ILE	CB	C	39.316	0.400	1
27	1	3	ILE	CG1	C	27.309	0.400	1
28	1	3	ILE	CG2	C	18.533	0.400	1
29	1	3	ILE	CD1	C	12.609	0.400	1
30	1	3	ILE	N	N	123.461	0.400	1
31	1	4	PRO	HA	H	4.289	0.020	1
32	1	4	PRO	HB2	H	2.249	0.020	2
33	1	4	PRO	HB3	H	1.882	0.020	2
34	1	4	PRO	HG2	H	1.912	0.020	2
35	1	4	PRO	HG3	H	1.840	0.020	2
36	1	4	PRO	HD2	H	4.041	0.020	2
37	1	4	PRO	HD3	H	3.596	0.020	2
38	1	4	PRO	CA	C	62.286	0.400	1
39	1	4	PRO	CB	C	31.754	0.400	1
40	1	4	PRO	CG	C	27.246	0.400	1
41	1	4	PRO	CD	C	51.724	0.400	1
42	1	5	ARG	H	H	8.011	0.020	1
43	1	5	ARG	HA	H	3.531	0.020	1
44	1	5	ARG	HB2	H	1.648	0.020	2
45	1	5	ARG	HB3	H	1.634	0.020	2
46	1	5	ARG	HG2	H	1.483	0.020	2
47	1	5	ARG	HG3	H	1.483	0.020	2
48	1	5	ARG	HD2	H	3.164	0.020	2
49	1	5	ARG	HD3	H	3.164	0.020	2
50	1	5	ARG	HE	H	7.359	0.020	1
51	1	5	ARG	CA	C	58.587	0.400	1
52	1	5	ARG	CB	C	30.347	0.400	1
53	1	5	ARG	CG	C	27.310	0.400	1
54	1	5	ARG	CD	C	43.611	0.400	1
55	1	5	ARG	N	N	119.805	0.400	1
56	1	5	ARG	NE	N	83.922	0.400	1
57	1	6	GLY	H	H	9.215	0.020	1
58	1	6	GLY	HA2	H	4.366	0.020	2
59	1	6	GLY	HA3	H	3.702	0.020	2
60	1	6	GLY	CA	C	50.773	0.400	1
61	1	6	GLY	N	N	112.708	0.400	1
62	1	7	GLU	H	H	7.486	0.020	1
63	1	7	GLU	HA	H	4.598	0.020	1
64	1	7	GLU	HB2	H	2.133	0.020	2
65	1	7	GLU	HB3	H	1.930	0.020	2
66	1	7	GLU	HG2	H	2.269	0.020	2
67	1	7	GLU	HG3	H	2.144	0.020	2
68	1	7	GLU	CB	C	30.438	0.400	1
69	1	7	GLU	CG	C	35.933	0.400	1
70	1	7	GLU	N	N	119.542	0.400	1
71	1	8	ILE	H	H	7.929	0.020	1
72	1	8	ILE	HA	H	4.476	0.020	1
73	1	8	ILE	HB	H	1.718	0.020	1
74	1	8	ILE	HG12	H	1.255	0.020	2
75	1	8	ILE	HG13	H	1.625	0.020	2
76	1	8	ILE	HG21	H	0.937	0.020	1
77	1	8	ILE	HG22	H	0.937	0.020	1
78	1	8	ILE	HG23	H	0.937	0.020	1
79	1	8	ILE	HD11	H	0.834	0.020	1
80	1	8	ILE	HD12	H	0.834	0.020	1
81	1	8	ILE	HD13	H	0.834	0.020	1
82	1	8	ILE	CB	C	38.074	0.400	1
83	1	8	ILE	CG1	C	28.096	0.400	1
84	1	8	ILE	CG2	C	17.463	0.400	1
85	1	8	ILE	CD1	C	12.838	0.400	1
86	1	8	ILE	N	N	119.645	0.400	1
87	1	9	CYS	H	H	7.787	0.020	1
88	1	9	CYS	HA	H	4.969	0.020	1
89	1	9	CYS	HB2	H	3.159	0.020	2
90	1	9	CYS	HB3	H	3.054	0.020	2
91	1	9	CYS	CA	C	53.037	0.400	1
92	1	9	CYS	CB	C	47.773	0.400	1
93	1	9	CYS	N	N	119.752	0.400	1
94	1	10	THR	H	H	9.622	0.020	1
95	1	10	THR	HA	H	4.464	0.020	1
96	1	10	THR	HB	H	4.243	0.020	1
97	1	10	THR	HG21	H	1.117	0.020	1
98	1	10	THR	HG22	H	1.117	0.020	1
99	1	10	THR	HG23	H	1.117	0.020	1
100	1	10	THR	CB	C	70.873	0.400	1
101	1	10	THR	CG2	C	21.692	0.400	1
102	1	10	THR	N	N	109.249	0.400	1
103	1	11	ASP	H	H	7.771	0.020	1
104	1	11	ASP	HA	H	4.897	0.020	1
105	1	11	ASP	HB2	H	2.721	0.020	2
106	1	11	ASP	HB3	H	2.423	0.020	2
107	1	11	ASP	CB	C	45.997	0.400	1
108	1	11	ASP	N	N	121.974	0.400	1
109	1	12	ASP	H	H	9.171	0.020	1
110	1	12	ASP	HA	H	4.201	0.020	1
111	1	12	ASP	HB2	H	2.594	0.020	1
112	1	12	ASP	HB3	H	2.665	0.020	1
113	1	12	ASP	CA	C	58.883	0.400	1
114	1	12	ASP	CB	C	43.268	0.400	1
115	1	12	ASP	N	N	124.572	0.400	1
116	1	13	CYS	H	H	8.911	0.020	1
117	1	13	CYS	HA	H	4.443	0.020	1
118	1	13	CYS	HB2	H	2.855	0.020	1
119	1	13	CYS	HB3	H	3.293	0.020	1
120	1	13	CYS	CB	C	35.612	0.400	1
121	1	13	CYS	N	N	114.384	0.400	1
122	1	14	GLU	H	H	7.783	0.020	1
123	1	14	GLU	HA	H	4.195	0.020	1
124	1	14	GLU	HB2	H	2.143	0.020	2
125	1	14	GLU	HB3	H	2.143	0.020	2
126	1	14	GLU	HG2	H	2.366	0.020	2
127	1	14	GLU	HG3	H	2.424	0.020	2
128	1	14	GLU	CA	C	57.040	0.400	1
129	1	14	GLU	CB	C	31.295	0.400	1
130	1	14	GLU	CG	C	35.812	0.400	1
131	1	14	GLU	N	N	116.462	0.400	1
132	1	15	CYS	H	H	7.165	0.020	1
133	1	15	CYS	HA	H	4.996	0.020	1
134	1	15	CYS	HB2	H	2.405	0.020	1
135	1	15	CYS	HB3	H	3.255	0.020	1
136	1	15	CYS	CA	C	55.392	0.400	1
137	1	15	CYS	CB	C	37.712	0.400	1
138	1	15	CYS	N	N	115.705	0.400	1
139	1	16	CYS	H	H	9.576	0.020	1
140	1	16	CYS	HA	H	4.454	0.020	1
141	1	16	CYS	HB2	H	2.566	0.020	1
142	1	16	CYS	HB3	H	3.241	0.020	1
143	1	16	CYS	CA	C	55.438	0.400	1
144	1	16	CYS	CB	C	41.015	0.400	1
145	1	16	CYS	N	N	125.323	0.400	1
146	1	17	GLY	H	H	8.726	0.020	1
147	1	17	GLY	HA2	H	4.278	0.020	2
148	1	17	GLY	HA3	H	3.727	0.020	2
149	1	17	GLY	CA	C	45.357	0.400	1
150	1	17	GLY	N	N	111.713	0.400	1
151	1	18	CYS	H	H	9.090	0.020	1
152	1	18	CYS	HA	H	4.656	0.020	1
153	1	18	CYS	HB2	H	3.141	0.020	2
154	1	18	CYS	HB3	H	2.954	0.020	2
155	1	18	CYS	CB	C	44.047	0.400	1
156	1	18	CYS	N	N	126.483	0.400	1
157	1	19	ASP	H	H	8.368	0.020	1
158	1	19	ASP	HA	H	4.680	0.020	1
159	1	19	ASP	HB2	H	2.736	0.020	2
160	1	19	ASP	HB3	H	2.565	0.020	2
161	1	19	ASP	CB	C	40.448	0.400	1
162	1	19	ASP	N	N	111.065	0.400	1
163	1	20	ASN	H	H	7.189	0.020	1
164	1	20	ASN	HA	H	5.385	0.020	1
165	1	20	ASN	HB2	H	2.754	0.020	2
166	1	20	ASN	HB3	H	2.029	0.020	2
167	1	20	ASN	HD21	H	7.554	0.020	2
168	1	20	ASN	HD22	H	6.937	0.020	2
169	1	20	ASN	CA	C	52.729	0.400	1
170	1	20	ASN	CB	C	40.449	0.400	1
171	1	20	ASN	N	N	115.671	0.400	1
172	1	20	ASN	ND2	N	112.285	0.400	1
173	1	21	GLN	H	H	9.100	0.020	1
174	1	21	GLN	HA	H	4.513	0.020	1
175	1	21	GLN	HB2	H	1.633	0.020	2
176	1	21	GLN	HB3	H	0.662	0.020	2
177	1	21	GLN	HG2	H	1.840	0.020	2
178	1	21	GLN	HG3	H	1.891	0.020	2
179	1	21	GLN	HE21	H	7.229	0.020	2
180	1	21	GLN	HE22	H	6.711	0.020	2
181	1	21	GLN	CB	C	32.122	0.400	1
182	1	21	GLN	CG	C	32.303	0.400	1
183	1	21	GLN	N	N	121.140	0.400	1
184	1	21	GLN	NE2	N	110.072	0.400	1
185	1	22	CYS	H	H	10.118	0.020	1
186	1	22	CYS	HA	H	4.817	0.020	1
187	1	22	CYS	HB2	H	2.609	0.020	1
188	1	22	CYS	HB3	H	2.789	0.020	1
189	1	22	CYS	CB	C	37.564	0.400	1
190	1	22	CYS	N	N	123.481	0.400	1
191	1	23	TYR	H	H	8.700	0.020	1
192	1	23	TYR	HA	H	4.436	0.020	1
193	1	23	TYR	HB2	H	2.672	0.020	1
194	1	23	TYR	HB3	H	3.007	0.020	1
195	1	23	TYR	HD1	H	6.930	0.020	1
196	1	23	TYR	HD2	H	6.930	0.020	1
197	1	23	TYR	CA	C	56.796	0.400	1
198	1	23	TYR	CB	C	39.997	0.400	1
199	1	23	TYR	CD2	C	133.049	0.400	3
200	1	23	TYR	N	N	130.650	0.400	1
201	1	24	CYS	H	H	8.230	0.020	1
202	1	24	CYS	HA	H	4.910	0.020	1
203	1	24	CYS	HB2	H	2.584	0.020	1
204	1	24	CYS	HB3	H	2.778	0.020	1
205	1	24	CYS	CA	C	56.328	0.400	1
206	1	24	CYS	CB	C	42.573	0.400	1
207	1	24	CYS	N	N	129.056	0.400	1
208	1	25	PRO	HA	H	4.272	0.020	1
209	1	25	PRO	HB2	H	1.731	0.020	1
210	1	25	PRO	HB3	H	2.202	0.020	1
211	1	25	PRO	HG2	H	1.877	0.020	2
212	1	25	PRO	HG3	H	1.801	0.020	2
213	1	25	PRO	HD2	H	3.609	0.020	2
214	1	25	PRO	HD3	H	3.546	0.020	2
215	1	25	PRO	CA	C	60.959	0.400	1
216	1	25	PRO	CB	C	30.766	0.400	1
217	1	25	PRO	CG	C	27.121	0.400	1
218	1	25	PRO	CD	C	51.090	0.400	1
219	1	26	PRO	HA	H	4.328	0.020	1
220	1	26	PRO	HB2	H	2.240	0.020	2
221	1	26	PRO	HB3	H	1.867	0.020	2
222	1	26	PRO	HG2	H	2.054	0.020	2
223	1	26	PRO	HG3	H	2.003	0.020	2
224	1	26	PRO	HD2	H	3.767	0.020	2
225	1	26	PRO	HD3	H	3.567	0.020	2
226	1	26	PRO	CA	C	63.518	0.400	1
227	1	26	PRO	CB	C	33.336	0.400	1
228	1	26	PRO	CG	C	27.496	0.400	1
229	1	26	PRO	CD	C	50.476	0.400	1
230	1	27	GLY	H	H	8.450	0.020	1
231	1	27	GLY	HA2	H	4.101	0.020	2
232	1	27	GLY	HA3	H	3.858	0.020	2
233	1	27	GLY	CA	C	45.410	0.400	1
234	1	27	GLY	N	N	109.923	0.400	1
235	1	28	SER	H	H	8.270	0.020	1
236	1	28	SER	HA	H	4.471	0.020	1
237	1	28	SER	HB2	H	3.871	0.020	2
238	1	28	SER	HB3	H	3.725	0.020	2
239	1	28	SER	CB	C	63.750	0.400	1
240	1	28	SER	N	N	116.756	0.400	1
241	1	29	SER	H	H	8.386	0.020	1
242	1	29	SER	HA	H	4.672	0.020	1
243	1	29	SER	HB2	H	4.330	0.020	2
244	1	29	SER	HB3	H	3.863	0.020	2
245	1	29	SER	CB	C	63.535	0.400	1
246	1	29	SER	N	N	117.885	0.400	1
247	1	30	LEU	H	H	7.883	0.020	1
248	1	30	LEU	HA	H	4.334	0.020	1
249	1	30	LEU	HB2	H	1.658	0.020	2
250	1	30	LEU	HB3	H	1.626	0.020	2
251	1	30	LEU	HD11	H	0.893	0.020	2
252	1	30	LEU	HD12	H	0.893	0.020	2
253	1	30	LEU	HD13	H	0.893	0.020	2
254	1	30	LEU	HD21	H	0.820	0.020	2
255	1	30	LEU	HD22	H	0.820	0.020	2
256	1	30	LEU	HD23	H	0.820	0.020	2
257	1	30	LEU	CA	C	55.392	0.400	1
258	1	30	LEU	CB	C	42.235	0.400	1
259	1	30	LEU	CD1	C	25.041	0.400	2
260	1	30	LEU	CD2	C	23.113	0.400	2
261	1	30	LEU	N	N	121.636	0.400	1
262	1	31	GLY	H	H	8.005	0.020	1
263	1	31	GLY	HA2	H	3.975	0.020	2
264	1	31	GLY	HA3	H	3.765	0.020	2
265	1	31	GLY	CA	C	45.392	0.400	1
266	1	31	GLY	N	N	107.867	0.400	1
267	1	32	ILE	H	H	7.528	0.020	1
268	1	32	ILE	HA	H	3.956	0.020	1
269	1	32	ILE	HB	H	1.586	0.020	1
270	1	32	ILE	HG12	H	1.170	0.020	2
271	1	32	ILE	HG13	H	0.966	0.020	2
272	1	32	ILE	HG21	H	0.733	0.020	1
273	1	32	ILE	HG22	H	0.733	0.020	1
274	1	32	ILE	HG23	H	0.733	0.020	1
275	1	32	ILE	HD11	H	0.589	0.020	1
276	1	32	ILE	HD12	H	0.589	0.020	1
277	1	32	ILE	HD13	H	0.589	0.020	1
278	1	32	ILE	CA	C	61.648	0.400	1
279	1	32	ILE	CB	C	38.483	0.400	1
280	1	32	ILE	CG1	C	27.009	0.400	1
281	1	32	ILE	CG2	C	12.761	0.400	1
282	1	32	ILE	CD1	C	17.282	0.400	1
283	1	32	ILE	N	N	118.474	0.400	1
284	1	33	PHE	H	H	7.780	0.020	1
285	1	33	PHE	HA	H	4.712	0.020	1
286	1	33	PHE	HB2	H	2.654	0.020	1
287	1	33	PHE	HB3	H	3.152	0.020	1
288	1	33	PHE	HD2	H	7.261	0.020	1
289	1	33	PHE	HE2	H	7.244	0.020	1
290	1	33	PHE	HZ	H	7.168	0.020	1
291	1	33	PHE	CB	C	40.761	0.400	1
292	1	33	PHE	CD1	C	131.508	0.400	3
293	1	33	PHE	CD2	C	131.464	0.400	3
294	1	33	PHE	CE2	C	129.844	0.400	3
295	1	33	PHE	CZ	C	131.442	0.400	1
296	1	33	PHE	N	N	120.774	0.400	1
297	1	34	LYS	H	H	8.202	0.020	1
298	1	34	LYS	HA	H	4.388	0.020	1
299	1	34	LYS	HB2	H	1.872	0.020	2
300	1	34	LYS	HB3	H	1.697	0.020	2
301	1	34	LYS	HG2	H	1.369	0.020	2
302	1	34	LYS	HG3	H	1.369	0.020	2
303	1	34	LYS	HD2	H	1.648	0.020	2
304	1	34	LYS	HD3	H	1.648	0.020	2
305	1	34	LYS	HE2	H	2.905	0.020	2
306	1	34	LYS	HE3	H	2.905	0.020	2
307	1	34	LYS	CA	C	55.223	0.400	1
308	1	34	LYS	CB	C	33.111	0.400	1
309	1	34	LYS	CG	C	23.480	0.400	1
310	1	34	LYS	CD	C	28.954	0.400	1
311	1	34	LYS	CE	C	42.325	0.400	1
312	1	34	LYS	N	N	120.682	0.400	1
313	1	35	CYS	H	H	8.522	0.020	1
314	1	35	CYS	HA	H	5.134	0.020	1
315	1	35	CYS	HB2	H	3.644	0.020	2
316	1	35	CYS	HB3	H	2.542	0.020	2
317	1	35	CYS	CA	C	56.651	0.400	1
318	1	35	CYS	CB	C	48.209	0.400	1
319	1	35	CYS	N	N	121.203	0.400	1
320	1	36	SER	H	H	8.617	0.020	1
321	1	36	SER	HA	H	5.225	0.020	1
322	1	36	SER	HB2	H	3.534	0.020	2
323	1	36	SER	HB3	H	3.328	0.020	2
324	1	36	SER	CA	C	57.766	0.400	1
325	1	36	SER	CB	C	66.566	0.400	1
326	1	36	SER	N	N	113.580	0.400	1
327	1	37	CYS	H	H	8.359	0.020	1
328	1	37	CYS	HA	H	5.301	0.020	1
329	1	37	CYS	HB2	H	2.923	0.020	1
330	1	37	CYS	HB3	H	3.088	0.020	1
331	1	37	CYS	CA	C	55.585	0.400	1
332	1	37	CYS	CB	C	39.814	0.400	1
333	1	37	CYS	N	N	121.376	0.400	1
334	1	38	ALA	H	H	10.040	0.020	1
335	1	38	ALA	HA	H	4.661	0.020	1
336	1	38	ALA	HB1	H	1.323	0.020	1
337	1	38	ALA	HB2	H	1.323	0.020	1
338	1	38	ALA	HB3	H	1.323	0.020	1
339	1	38	ALA	CB	C	19.232	0.400	1
340	1	38	ALA	N	N	129.619	0.400	1
341	1	39	HIS	H	H	8.785	0.020	1
342	1	39	HIS	HA	H	4.831	0.020	1
343	1	39	HIS	HB2	H	3.050	0.020	2
344	1	39	HIS	HB3	H	2.985	0.020	2
345	1	39	HIS	HD2	H	7.164	0.020	1
346	1	39	HIS	HE1	H	8.555	0.020	1
347	1	39	HIS	CB	C	28.634	0.400	1
348	1	39	HIS	CD2	C	131.142	0.400	1
349	1	39	HIS	CE1	C	136.494	0.400	1
350	1	39	HIS	N	N	120.341	0.400	1
351	1	40	ALA	H	H	8.592	0.020	1
352	1	40	ALA	HA	H	4.353	0.020	1
353	1	40	ALA	HB1	H	0.784	0.020	1
354	1	40	ALA	HB2	H	0.784	0.020	1
355	1	40	ALA	HB3	H	0.784	0.020	1
356	1	40	ALA	CA	C	59.618	0.400	1
357	1	40	ALA	CB	C	20.665	0.400	1
358	1	40	ALA	N	N	132.147	0.400	1
359	1	41	ASN	H	H	7.549	0.020	1
360	1	41	ASN	HA	H	4.478	0.020	1
361	1	41	ASN	HB2	H	3.075	0.020	2
362	1	41	ASN	HB3	H	2.960	0.020	2
363	1	41	ASN	HD21	H	7.675	0.020	2
364	1	41	ASN	HD22	H	7.021	0.020	2
365	1	41	ASN	CB	C	39.295	0.400	1
366	1	41	ASN	N	N	113.724	0.400	1
367	1	41	ASN	ND2	N	113.481	0.400	1
368	1	42	LYS	H	H	8.349	0.020	1
369	1	42	LYS	HA	H	4.045	0.020	1
370	1	42	LYS	HB2	H	1.701	0.020	2
371	1	42	LYS	HB3	H	1.573	0.020	2
372	1	42	LYS	HG2	H	1.047	0.020	2
373	1	42	LYS	HG3	H	0.798	0.020	2
374	1	42	LYS	HD2	H	1.497	0.020	2
375	1	42	LYS	HD3	H	1.497	0.020	2
376	1	42	LYS	CA	C	58.635	0.400	1
377	1	42	LYS	CB	C	32.139	0.400	1
378	1	42	LYS	CG	C	23.771	0.400	1
379	1	42	LYS	CD	C	29.259	0.400	1
380	1	42	LYS	N	N	117.757	0.400	1
381	1	43	TYR	H	H	7.867	0.020	1
382	1	43	TYR	HA	H	4.437	0.020	1
383	1	43	TYR	HB2	H	2.930	0.020	1
384	1	43	TYR	HB3	H	3.206	0.020	1
385	1	43	TYR	HD1	H	7.061	0.020	1
386	1	43	TYR	HD2	H	7.061	0.020	1
387	1	43	TYR	HE1	H	6.834	0.020	1
388	1	43	TYR	HE2	H	6.834	0.020	1
389	1	43	TYR	CB	C	37.402	0.400	1
390	1	43	TYR	CD2	C	133.046	0.400	3
391	1	43	TYR	CE2	C	118.363	0.400	3
392	1	43	TYR	N	N	119.460	0.400	1
393	1	44	PHE	H	H	7.995	0.020	1
394	1	44	PHE	HA	H	4.139	0.020	1
395	1	44	PHE	HB2	H	2.943	0.020	1
396	1	44	PHE	HB3	H	3.144	0.020	1
397	1	44	PHE	HD1	H	7.160	0.020	1
398	1	44	PHE	HD2	H	7.160	0.020	1
399	1	44	PHE	HE1	H	7.171	0.020	1
400	1	44	PHE	HE2	H	7.171	0.020	1
401	1	44	PHE	HZ	H	7.295	0.020	1
402	1	44	PHE	CA	C	61.515	0.400	1
403	1	44	PHE	CB	C	40.518	0.400	1
404	1	44	PHE	CD2	C	132.301	0.400	3
405	1	44	PHE	CE2	C	131.882	0.400	3
406	1	44	PHE	CZ	C	131.871	0.400	1
407	1	44	PHE	N	N	122.280	0.400	1
408	1	45	CYS	H	H	8.269	0.020	1
409	1	45	CYS	HA	H	4.599	0.020	1
410	1	45	CYS	HB2	H	3.187	0.020	2
411	1	45	CYS	HB3	H	2.933	0.020	2
412	1	45	CYS	CB	C	40.501	0.400	1
413	1	45	CYS	N	N	117.320	0.400	1
414	1	46	ASN	H	H	7.839	0.020	1
415	1	46	ASN	HA	H	4.249	0.020	1
416	1	46	ASN	HB2	H	2.748	0.020	2
417	1	46	ASN	HB3	H	2.748	0.020	2
418	1	46	ASN	HD21	H	8.308	0.020	2
419	1	46	ASN	HD22	H	6.590	0.020	2
420	1	46	ASN	CA	C	56.301	0.400	1
421	1	46	ASN	CB	C	37.785	0.400	1
422	1	46	ASN	N	N	115.684	0.400	1
423	1	46	ASN	ND2	N	114.272	0.400	1
424	1	47	ARG	H	H	7.124	0.020	1
425	1	47	ARG	HA	H	4.068	0.020	1
426	1	47	ARG	HB2	H	1.691	0.020	2
427	1	47	ARG	HB3	H	1.673	0.020	2
428	1	47	ARG	HG2	H	1.558	0.020	2
429	1	47	ARG	HG3	H	1.558	0.020	2
430	1	47	ARG	HD2	H	3.163	0.020	2
431	1	47	ARG	HD3	H	3.163	0.020	2
432	1	47	ARG	HE	H	7.254	0.020	1
433	1	47	ARG	CA	C	58.042	0.400	1
434	1	47	ARG	CB	C	29.780	0.400	1
435	1	47	ARG	CG	C	26.993	0.400	1
436	1	47	ARG	CD	C	43.337	0.400	1
437	1	47	ARG	N	N	118.867	0.400	1
438	1	47	ARG	NE	N	84.722	0.400	1
439	1	48	LYS	H	H	8.498	0.020	1
440	1	48	LYS	HA	H	3.489	0.020	1
441	1	48	LYS	HB2	H	1.840	0.020	2
442	1	48	LYS	HB3	H	1.819	0.020	2
443	1	48	LYS	HG2	H	1.291	0.020	2
444	1	48	LYS	HG3	H	1.291	0.020	2
445	1	48	LYS	HD2	H	1.204	0.020	2
446	1	48	LYS	HD3	H	1.204	0.020	2
447	1	48	LYS	CA	C	60.111	0.400	1
448	1	48	LYS	CB	C	33.107	0.400	1
449	1	48	LYS	CG	C	22.747	0.400	1
450	1	48	LYS	CD	C	32.361	0.400	1
451	1	48	LYS	N	N	123.600	0.400	1
452	1	49	LYS	H	H	8.168	0.020	1
453	1	49	LYS	HA	H	3.883	0.020	1
454	1	49	LYS	HB2	H	1.791	0.020	2
455	1	49	LYS	HB3	H	1.767	0.020	2
456	1	49	LYS	HG2	H	1.400	0.020	2
457	1	49	LYS	HG3	H	1.400	0.020	2
458	1	49	LYS	HD2	H	1.618	0.020	2
459	1	49	LYS	HD3	H	1.618	0.020	2
460	1	49	LYS	CA	C	59.287	0.400	1
461	1	49	LYS	CB	C	32.403	0.400	1
462	1	49	LYS	CG	C	24.494	0.400	1
463	1	49	LYS	CD	C	28.957	0.400	1
464	1	49	LYS	N	N	116.571	0.400	1
465	1	50	GLU	H	H	6.951	0.020	1
466	1	50	GLU	HA	H	4.111	0.020	1
467	1	50	GLU	HB2	H	2.052	0.020	2
468	1	50	GLU	HB3	H	2.035	0.020	2
469	1	50	GLU	HG2	H	2.367	0.020	2
470	1	50	GLU	HG3	H	2.241	0.020	2
471	1	50	GLU	CA	C	57.815	0.400	1
472	1	50	GLU	CB	C	29.818	0.400	1
473	1	50	GLU	CG	C	35.408	0.400	1
474	1	50	GLU	N	N	115.529	0.400	1
475	1	51	LYS	H	H	7.847	0.020	1
476	1	51	LYS	HA	H	4.250	0.020	1
477	1	51	LYS	HB2	H	1.886	0.020	2
478	1	51	LYS	HB3	H	1.813	0.020	2
479	1	51	LYS	HG2	H	1.474	0.020	2
480	1	51	LYS	HG3	H	1.474	0.020	2
481	1	51	LYS	HD2	H	1.646	0.020	2
482	1	51	LYS	HD3	H	1.646	0.020	2
483	1	51	LYS	HE2	H	2.959	0.020	2
484	1	51	LYS	HE3	H	2.959	0.020	2
485	1	51	LYS	CA	C	58.200	0.400	1
486	1	51	LYS	CB	C	33.412	0.400	1
487	1	51	LYS	CG	C	25.034	0.400	1
488	1	51	LYS	CD	C	29.180	0.400	1
489	1	51	LYS	CE	C	42.162	0.400	1
490	1	51	LYS	N	N	117.679	0.400	1
491	1	52	CYS	H	H	8.279	0.020	1
492	1	52	CYS	HA	H	4.858	0.020	1
493	1	52	CYS	HB2	H	2.796	0.020	1
494	1	52	CYS	HB3	H	3.273	0.020	1
495	1	52	CYS	CA	C	53.583	0.400	1
496	1	52	CYS	CB	C	37.534	0.400	1
497	1	52	CYS	N	N	116.723	0.400	1
498	1	53	LYS	H	H	7.653	0.020	1
499	1	53	LYS	HA	H	4.177	0.020	1
500	1	53	LYS	HB2	H	1.837	0.020	2
501	1	53	LYS	HB3	H	1.837	0.020	2
502	1	53	LYS	HG2	H	1.371	0.020	2
503	1	53	LYS	HG3	H	1.371	0.020	2
504	1	53	LYS	HD2	H	1.653	0.020	2
505	1	53	LYS	HD3	H	1.653	0.020	2
506	1	53	LYS	HE2	H	2.973	0.020	2
507	1	53	LYS	HE3	H	2.973	0.020	2
508	1	53	LYS	CA	C	57.032	0.400	1
509	1	53	LYS	CB	C	32.565	0.400	1
510	1	53	LYS	CG	C	24.809	0.400	1
511	1	53	LYS	CD	C	29.657	0.400	1
512	1	53	LYS	CE	C	42.168	0.400	1
513	1	53	LYS	N	N	121.721	0.400	1
514	1	54	LYS	H	H	8.254	0.020	1
515	1	54	LYS	HA	H	4.309	0.020	1
516	1	54	LYS	HB2	H	1.700	0.020	1
517	1	54	LYS	HB3	H	1.831	0.020	1
518	1	54	LYS	HG2	H	1.400	0.020	2
519	1	54	LYS	HG3	H	1.400	0.020	2
520	1	54	LYS	HD2	H	1.650	0.020	2
521	1	54	LYS	HD3	H	1.650	0.020	2
522	1	54	LYS	HE2	H	2.971	0.020	2
523	1	54	LYS	HE3	H	2.971	0.020	2
524	1	54	LYS	CA	C	56.002	0.400	1
525	1	54	LYS	CB	C	33.118	0.400	1
526	1	54	LYS	CG	C	24.831	0.400	1
527	1	54	LYS	CD	C	29.704	0.400	1
528	1	54	LYS	CE	C	42.167	0.400	1
529	1	54	LYS	N	N	122.699	0.400	1
530	1	55	ALA	H	H	7.909	0.020	1
531	1	55	ALA	HA	H	4.046	0.020	1
532	1	55	ALA	HB1	H	1.288	0.020	1
533	1	55	ALA	HB2	H	1.288	0.020	1
534	1	55	ALA	HB3	H	1.288	0.020	1
535	1	55	ALA	CA	C	53.665	0.400	1
536	1	55	ALA	CB	C	20.201	0.400	1
537	1	55	ALA	N	N	131.016	0.400	1

Release date

2023-01-04

Citation

Recombinant Production, NMR Solution Structure, and Membrane Interaction of the Phα1β Toxin, a TRPA1 Modulator from the Brazilian Armed Spider Phoneutria nigriventer
Lyukmanova, E.N., Mironov, P.A., Kulbatskii, D.S., Shulepko, M.A., Paramonov, A.S., Chernaya, E.M., Logashina, Y.A., Andreev, Y.A., Kirpichnikov, M.P., Shenkarev, Z.O.
Toxins (Basel). (2023), 15, 378-378, PubMed 37368679 , DOI 10.3390/toxins15060378 , Abstract

Related entities 1. Omega-ctenitoxin-Pn4a, : 1 : 1 : 16 entities Detail

Experiments performed 6 experiments Detail