BMRB: 31095

Solution NMR structure of designed peptide BH21 (TMIEDPEAGHFHTSSA)

Authors

McShan, A.C., Torres, M.P.

Assembly

Designed peptide BH21

Entity

1. Designed peptide BH21 (polymer), 16 monomers, 1729.820 Da Detail

TMIEDPEAGH FHTSSA

Formula weight

1729.82 Da

Source organism

synthetic construct

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 61, ¹³C: 31, ¹⁵N: 15 assignments Detail

Download

• NMR-STAR v3.1 (partial)
• BMRB/XML (partial)
• CSV
• TSV

ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	1	THR	H	H	8.295
2	1	1	THR	HA	H	4.211
3	1	1	THR	HB	H	4.138
4	1	1	THR	CA	C	62.284
5	1	1	THR	CB	C	69.733
6	1	1	THR	N	N	120.754
7	1	2	MET	H	H	8.578
8	1	2	MET	HA	H	4.472
9	1	2	MET	HB2	H	1.971
10	1	2	MET	HB3	H	1.971
11	1	2	MET	CA	C	55.399
12	1	2	MET	CB	C	32.622
13	1	2	MET	N	N	123.724
14	1	3	ILE	H	H	8.292
15	1	3	ILE	HA	H	4.086
16	1	3	ILE	HB	H	1.789
17	1	3	ILE	CA	C	61.059
18	1	3	ILE	CB	C	38.489
19	1	3	ILE	N	N	123.393
20	1	4	GLU	H	H	8.533
21	1	4	GLU	HA	H	4.295
22	1	4	GLU	HB2	H	1.903
23	1	4	GLU	HB3	H	1.903
24	1	4	GLU	CA	C	55.577
25	1	4	GLU	CB	C	28.930
26	1	4	GLU	N	N	125.155
27	1	5	ASP	H	H	8.623
28	1	5	ASP	HA	H	4.910
29	1	5	ASP	HB2	H	2.675
30	1	5	ASP	HB3	H	2.675
31	1	5	ASP	CA	C	51.284
32	1	5	ASP	CB	C	39.133
33	1	5	ASP	N	N	121.884
34	1	6	PRO	HA	H	4.348
35	1	6	PRO	HB2	H	1.922
36	1	6	PRO	HB3	H	1.922
37	1	6	PRO	CA	C	63.831
38	1	6	PRO	CB	C	32.034
39	1	7	GLU	H	H	8.370
40	1	7	GLU	HA	H	4.232
41	1	7	GLU	HB2	H	1.933
42	1	7	GLU	HB3	H	1.933
43	1	7	GLU	CA	C	55.935
44	1	7	GLU	CB	C	28.338
45	1	7	GLU	N	N	118.773
46	1	8	ALA	H	H	8.049
47	1	8	ALA	HA	H	4.193
48	1	8	ALA	HB1	H	1.374
49	1	8	ALA	HB2	H	1.374
50	1	8	ALA	HB3	H	1.374
51	1	8	ALA	CA	C	53.014
52	1	8	ALA	CB	C	18.946
53	1	8	ALA	N	N	124.295
54	1	9	GLY	H	H	8.378
55	1	9	GLY	HA2	H	3.811
56	1	9	GLY	HA3	H	3.811
57	1	9	GLY	CA	C	45.275
58	1	9	GLY	N	N	107.847
59	1	10	HIS	H	H	8.222
60	1	10	HIS	HA	H	4.612
61	1	10	HIS	HB2	H	3.044
62	1	10	HIS	HB3	H	3.044
63	1	10	HIS	CA	C	55.015
64	1	10	HIS	CB	C	28.795
65	1	10	HIS	N	N	117.832
66	1	11	PHE	H	H	8.361
67	1	11	PHE	HA	H	4.560
68	1	11	PHE	HB2	H	2.960
69	1	11	PHE	HB3	H	2.960
70	1	11	PHE	CA	C	57.860
71	1	11	PHE	CB	C	39.609
72	1	11	PHE	N	N	121.264
73	1	12	HIS	H	H	8.555
74	1	12	HIS	HA	H	4.703
75	1	12	HIS	HB2	H	3.116
76	1	12	HIS	HB3	H	3.116
77	1	12	HIS	CA	C	55.061
78	1	12	HIS	CB	C	29.181
79	1	12	HIS	N	N	121.056
80	1	13	THR	H	H	8.339
81	1	13	THR	HA	H	4.314
82	1	13	THR	HB	H	4.198
83	1	13	THR	CA	C	61.782
84	1	13	THR	CB	C	69.881
85	1	13	THR	N	N	116.567
86	1	14	SER	H	H	8.558
87	1	14	SER	HA	H	4.430
88	1	14	SER	HB2	H	3.829
89	1	14	SER	HB3	H	3.829
90	1	14	SER	CA	C	58.390
91	1	14	SER	CB	C	63.688
92	1	14	SER	N	N	118.589
93	1	15	SER	H	H	8.602
94	1	15	SER	HA	H	4.496
95	1	15	SER	HB2	H	3.847
96	1	15	SER	HB3	H	3.847
97	1	15	SER	CA	C	58.275
98	1	15	SER	CB	C	63.707
99	1	15	SER	N	N	118.641
100	1	16	ALA	H	H	8.405
101	1	16	ALA	HA	H	4.249
102	1	16	ALA	HB1	H	1.358
103	1	16	ALA	HB2	H	1.358
104	1	16	ALA	HB3	H	1.358
105	1	16	ALA	CA	C	52.442
106	1	16	ALA	CB	C	19.321
107	1	16	ALA	N	N	126.989

Release date

2023-09-14

Citation

Solution NMR structure of designed peptide BH21 (TMIEDPEAGHFHTSSA)
McShan, A.C., Torres, M.P.

Related entities 1. Designed peptide BH21, : 1 entities Detail

Experiments performed 4 experiments Detail