BMRB: 31094

Solution NMR structure of designed peptide BH33 (RHYYKFNSTGRHYHYY)

Authors

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

Assembly

Designed peptide BH33

Entity

1. Designed peptide BH33 (polymer), 16 monomers, 2192.353 Da Detail

RHYYKFNSTG RHYHYY

Formula weight

2192.353 Da

Source organism

synthetic construct

Exptl. method

solution NMR

Data set

assigned_chemical_shifts

Chemcal Shifts

¹H: 62, ¹³C: 31, ¹⁵N: 16 assignments Detail

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ID	Entity ID	Seq ID	Comp ID	Atom ID	Atom type	Val	Val err	Ambig. code
1	1	1	ARG	H	H	8.221
2	1	1	ARG	HA	H	4.132
3	1	1	ARG	HB2	H	1.576
4	1	1	ARG	HB3	H	1.576
5	1	1	ARG	CA	C	56.150
6	1	1	ARG	CB	C	29.200
7	1	1	ARG	N	N	123.667
8	1	2	HIS	H	H	8.391
9	1	2	HIS	HA	H	4.444
10	1	2	HIS	HB2	H	2.900
11	1	2	HIS	HB3	H	2.900
12	1	2	HIS	CA	C	54.746
13	1	2	HIS	CB	C	29.388
14	1	2	HIS	N	N	121.675
15	1	3	TYR	H	H	8.235
16	1	3	TYR	HA	H	4.381
17	1	3	TYR	HB2	H	2.976
18	1	3	TYR	HB3	H	2.976
19	1	3	TYR	CA	C	57.584
20	1	3	TYR	CB	C	38.960
21	1	3	TYR	N	N	124.331
22	1	4	TYR	H	H	8.265
23	1	4	TYR	HA	H	4.518
24	1	4	TYR	HB2	H	2.994
25	1	4	TYR	HB3	H	2.994
26	1	4	TYR	CA	C	57.786
27	1	4	TYR	CB	C	39.609
28	1	4	TYR	N	N	123.064
29	1	5	LYS	H	H	8.265
30	1	5	LYS	HA	H	4.468
31	1	5	LYS	HB2	H	2.746
32	1	5	LYS	HB3	H	2.746
33	1	5	LYS	CA	C	57.542
34	1	5	LYS	CB	C	39.049
35	1	5	LYS	N	N	122.901
36	1	6	PHE	H	H	8.402
37	1	6	PHE	HA	H	4.647
38	1	6	PHE	HB2	H	2.748
39	1	6	PHE	HB3	H	2.748
40	1	6	PHE	CA	C	52.826
41	1	6	PHE	CB	C	38.858
42	1	6	PHE	N	N	121.427
43	1	7	ASN	H	H	8.274
44	1	7	ASN	HA	H	4.404
45	1	7	ASN	HB2	H	2.824
46	1	7	ASN	HB3	H	2.824
47	1	7	ASN	CA	C	57.781
48	1	7	ASN	CB	C	38.966
49	1	7	ASN	N	N	123.383
50	1	8	SER	H	H	8.394
51	1	8	SER	HA	H	4.358
52	1	8	SER	HB2	H	3.807
53	1	8	SER	HB3	H	3.807
54	1	8	SER	CA	C	58.824
55	1	8	SER	CB	C	63.635
56	1	8	SER	N	N	116.933
57	1	9	THR	H	H	8.227
58	1	9	THR	HA	H	4.328
59	1	9	THR	HB	H	4.266
60	1	9	THR	CA	C	62.202
61	1	9	THR	CB	C	69.712
62	1	9	THR	N	N	114.888
63	1	10	GLY	H	H	8.379
64	1	10	GLY	HA2	H	3.861
65	1	10	GLY	HA3	H	3.861
66	1	10	GLY	CA	C	45.238
67	1	10	GLY	N	N	111.018
68	1	11	ARG	H	H	8.316
69	1	11	ARG	HA	H	4.076
70	1	11	ARG	HB2	H	1.560
71	1	11	ARG	HB3	H	1.560
72	1	11	ARG	CA	C	56.177
73	1	11	ARG	CB	C	30.612
74	1	11	ARG	N	N	126.745
75	1	12	HIS	H	H	8.592
76	1	12	HIS	HA	H	4.628
77	1	12	HIS	HB2	H	3.107
78	1	12	HIS	HB3	H	3.107
79	1	12	HIS	CA	C	54.761
80	1	12	HIS	CB	C	28.981
81	1	12	HIS	N	N	119.890
82	1	13	TYR	H	H	8.334
83	1	13	TYR	HA	H	4.421
84	1	13	TYR	HB2	H	2.869
85	1	13	TYR	HB3	H	2.869
86	1	13	TYR	CA	C	58.030
87	1	13	TYR	CB	C	39.038
88	1	13	TYR	N	N	122.164
89	1	14	HIS	H	H	8.584
90	1	14	HIS	HA	H	4.582
91	1	14	HIS	HB2	H	2.948
92	1	14	HIS	HB3	H	2.948
93	1	14	HIS	CA	C	54.686
94	1	14	HIS	CB	C	29.216
95	1	14	HIS	N	N	120.091
96	1	15	TYR	H	H	8.339
97	1	15	TYR	HA	H	4.477
98	1	15	TYR	HB2	H	2.871
99	1	15	TYR	HB3	H	2.871
100	1	15	TYR	CA	C	57.624
101	1	15	TYR	CB	C	39.029
102	1	15	TYR	N	N	122.386
103	1	16	TYR	H	H	8.265
104	1	16	TYR	HA	H	4.491
105	1	16	TYR	HB2	H	2.744
106	1	16	TYR	HB3	H	2.744
107	1	16	TYR	CA	C	57.710
108	1	16	TYR	CB	C	39.051
109	1	16	TYR	N	N	121.912

Release date

2023-09-14

Citation

Solution NMR structure of designed peptide BH33 (RHYYKFNSTGRHYHYY)
McShan, A.C., Torres, M.P.

Related entities 1. Designed peptide BH33, : 1 : 2 entities Detail

Experiments performed 4 experiments Detail