A1BIM

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O28	C27	doub	1.21Å	1.27Å
C27	C10	sing	1.51Å	1.50Å
C27	O29	sing	1.34Å	1.27Å
C11	C10	sing	1.53Å	1.55Å
C11	S16	sing	1.82Å	1.81Å
C11	N12	sing	1.45Å	1.51Å
C10	N09	sing	1.46Å	1.44Å
S16	C15	sing	1.82Å	1.81Å
C15	C14	sing	1.52Å	1.42Å
N12	C13	doub	1.27Å	1.30Å
C13	C14	sing	1.47Å	1.50Å
C13	C24	sing	1.49Å	1.47Å
O25	C24	doub	1.21Å	1.26Å
C14	C17	doub	1.33Å	1.34Å
C24	O26	sing	1.35Å	1.26Å
N09	C07	sing	1.35Å	1.34Å
O08	C07	doub	1.21Å	1.18Å
C07	C06	sing	1.48Å	1.53Å
O04	N05	sing	1.42Å	1.40Å
C06	N05	doub	1.30Å	1.25Å
C06	C30	sing	1.48Å	1.53Å
C31	C30	doub	1.35Å	1.39Å	Aromatic
C31	S32	sing	1.76Å	1.76Å	Aromatic
C30	N35	sing	1.33Å	1.32Å	Aromatic
S32	C33	sing	1.76Å	1.75Å	Aromatic
N35	C33	doub	1.30Å	1.32Å	Aromatic
C33	N34	sing	1.39Å	1.44Å
C11	H111	sing	1.09Å	1.10Å
C15	H152	sing	1.09Å	1.10Å
C15	H151	sing	1.09Å	1.10Å
C17	H2	sing	1.08Å	1.08Å
C17	H3	sing	1.08Å	1.08Å
C10	H101	sing	1.09Å	1.10Å
C31	H311	sing	1.08Å	1.08Å
N09	H091	sing	0.97Å	1.00Å
N34	H341	sing	0.97Å	1.00Å
N34	H342	sing	0.97Å	1.00Å
O26	H6	sing	0.97Å	0.95Å
O29	H7	sing	0.97Å	0.95Å
O04	C1	sing	1.43Å	79.41Å
C1	C2	sing	1.53Å	0.00Å
C1	C3	sing	1.53Å	0.00Å
C1	C4	sing	1.51Å	0.00Å
C4	O1	doub	1.21Å	0.00Å
C4	O2	sing	1.34Å	0.00Å
C2	H1	sing	1.09Å	0.00Å
C2	H4	sing	1.09Å	0.00Å
C2	H5	sing	1.09Å	0.00Å
C3	H8	sing	1.09Å	0.00Å
C3	H9	sing	1.09Å	0.00Å
C3	H10	sing	1.09Å	0.00Å
O2	H11	sing	0.97Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O28	C27	C10	120.2°	120.0°
O28	C27	O29	122.0°	120.0°
C10	C27	O29	117.8°	120.0°
C27	C10	C11	106.8°	109.5°
C27	C10	N09	106.3°	109.5°
C27	C10	H101	111.6°	109.5°
C27	O29	H7	109.5°	117.0°
C10	C11	S16	106.7°	109.3°
C10	C11	N12	103.9°	109.3°
C11	C10	N09	108.5°	109.5°
C10	C11	H111	110.2°	109.3°
C11	C10	H101	110.8°	109.5°
S16	C11	N12	117.9°	110.3°
C11	S16	C15	94.9°	101.4°
S16	C11	H111	107.2°	109.3°
C11	N12	C13	116.3°	127.7°
N12	C11	H111	110.8°	109.2°
C10	N09	C07	123.6°	120.0°
N09	C10	H101	112.5°	109.5°
C10	N09	H091	118.2°	120.0°
S16	C15	C14	109.5°	106.7°
S16	C15	H152	109.5°	110.0°
S16	C15	H151	109.4°	110.2°
C15	C14	C13	115.8°	119.3°
C15	C14	C17	117.7°	120.3°
C14	C15	H152	109.5°	110.0°
C14	C15	H151	109.5°	110.0°
N12	C13	C14	119.8°	126.3°
N12	C13	C24	115.9°	116.8°
C14	C13	C24	116.8°	116.8°
C13	C14	C17	118.2°	120.4°
C13	C24	O25	120.3°	120.0°
C13	C24	O26	118.9°	120.0°
O25	C24	O26	120.8°	120.0°
C14	C17	H2	120.0°	120.0°
C14	C17	H3	120.0°	120.0°
C24	O26	H6	109.5°	117.0°
N09	C07	O08	121.7°	120.0°
N09	C07	C06	117.6°	120.0°
C07	N09	H091	118.2°	120.0°
O08	C07	C06	120.6°	120.0°
C07	C06	N05	120.6°	120.0°
C07	C06	C30	118.8°	120.0°
O04	N05	C06	119.0°	120.0°
N05	O04	C1	47.9°	114.0°
N05	C06	C30	120.6°	120.0°
C06	C30	C31	121.5°	122.4°
C06	C30	N35	121.7°	122.4°
C30	C31	S32	105.7°	108.3°
C31	C30	N35	116.8°	115.2°
C30	C31	H311	127.1°	125.9°
C31	S32	C33	92.4°	90.1°
S32	C31	H311	127.2°	125.8°
C30	N35	C33	116.3°	116.9°
S32	C33	N35	108.7°	109.5°
S32	C33	N34	124.8°	125.2°
N35	C33	N34	126.5°	125.2°
C33	N34	H341	109.5°	120.0°
C33	N34	H342	109.5°	120.0°
H152	C15	H151	109.5°	110.0°
H2	C17	H3	120.0°	120.0°
H341	N34	H342	109.5°	120.0°
O04	C1	C2	90.0°	109.5°
O04	C1	C3	90.0°	109.5°
O04	C1	C4	90.0°	109.5°
C2	C1	C3	90.0°	109.5°
C2	C1	C4	90.0°	109.5°
C1	C2	H1	90.0°	109.5°
C1	C2	H4	90.0°	109.4°
C1	C2	H5	90.0°	109.4°
C3	C1	C4	90.0°	109.5°
C1	C3	H8	90.0°	109.5°
C1	C3	H9	90.0°	109.5°
C1	C3	H10	90.0°	109.5°
C1	C4	O1	90.0°	120.0°
C1	C4	O2	90.0°	120.0°
O1	C4	O2	90.0°	120.0°
C4	O2	H11	90.0°	117.0°
H1	C2	H4	90.0°	109.5°
H1	C2	H5	90.0°	109.5°
H4	C2	H5	90.0°	109.5°
H8	C3	H9	90.0°	109.4°
H8	C3	H10	90.0°	109.5°
H9	C3	H10	90.0°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O28	C27	C10	O29	178.3°	179.9°
O28	C27	C10	C11	46.8°	120.0°
O28	C27	C10	N09	162.6°	0.0°
O28	C27	C10	H101	74.4°	120.0°
O28	C27	O29	H7	0.0°	0.1°
C27	C10	C11	N09	114.3°	120.0°
C27	C10	C11	H101	121.7°	120.0°
C27	C10	C11	S16	173.6°	65.0°
C27	C10	C11	N12	61.1°	174.1°
C27	C10	N09	H101	122.4°	120.0°
C27	C10	N09	C07	153.3°	85.0°
C27	C10	C11	H111	57.6°	54.6°
C27	C10	N09	H091	26.7°	95.0°
C10	C27	O29	H7	178.3°	180.0°
O29	C27	C10	C11	131.5°	60.0°
O29	C27	C10	N09	15.8°	180.0°
O29	C27	C10	H101	107.3°	60.0°
C10	C11	S16	N12	116.3°	120.3°
C10	C11	S16	H111	118.0°	119.7°
C10	C11	N12	H111	118.3°	119.6°
C11	C10	N09	H101	123.0°	120.0°
C10	C11	S16	C15	163.4°	167.5°
C10	C11	N12	C13	162.5°	143.4°
C11	C10	N09	C07	92.2°	155.0°
C11	C10	N09	H091	87.8°	25.0°
S16	C11	N12	H111	124.0°	120.2°
S16	C11	C10	N09	72.1°	175.0°
C11	S16	C15	C14	54.9°	55.5°
S16	C11	N12	C13	44.7°	23.1°
C11	S16	C15	H152	65.1°	174.9°
C11	S16	C15	H151	175.0°	63.8°
S16	C11	C10	H101	51.9°	55.0°
N12	C11	C10	N09	53.2°	54.1°
N12	C11	S16	C15	47.1°	47.2°
C11	N12	C13	C14	41.8°	1.1°
C11	N12	C13	C24	169.3°	178.9°
N12	C11	C10	H101	177.2°	65.9°
C10	N09	C07	H091	180.0°	180.0°
C10	N09	C07	O08	0.5°	4.1°
C10	N09	C07	C06	179.1°	175.8°
N09	C10	C11	H111	171.8°	65.3°
S16	C15	C14	H152	120.0°	119.3°
S16	C15	C14	H151	120.0°	119.4°
S16	C15	C14	C13	63.1°	42.0°
S16	C15	C14	C17	84.8°	138.0°
C15	S16	C11	H111	78.6°	72.9°
S16	C15	H152	H151	120.0°	121.5°
C15	C14	C13	N12	55.2°	12.5°
C15	C14	C13	C17	147.7°	180.0°
C15	C14	C13	C24	156.2°	167.5°
C14	C15	H152	H151	120.0°	121.3°
C15	C14	C17	H2	147.0°	172.8°
C15	C14	C17	H3	32.9°	7.2°
N12	C13	C14	C24	148.6°	180.0°
N12	C13	C24	O25	133.0°	172.2°
N12	C13	C14	C17	92.5°	167.5°
N12	C13	C24	O26	47.2°	7.8°
C13	N12	C11	H111	79.3°	97.0°
C14	C13	C24	O25	77.2°	7.8°
C14	C13	C24	O26	102.6°	172.2°
C13	C14	C15	H152	56.9°	161.3°
C13	C14	C15	H151	176.9°	77.4°
C13	C14	C17	H2	0.0°	7.2°
C13	C14	C17	H3	180.0°	172.8°
C13	C24	O25	O26	179.8°	180.0°
C24	C13	C14	C17	56.1°	12.4°
C13	C24	O26	H6	179.8°	180.0°
O25	C24	O26	H6	0.0°	0.0°
C17	C14	C15	H152	155.2°	18.7°
C17	C14	C15	H151	35.2°	102.6°
C14	C17	H2	H3	180.0°	180.0°
N09	C07	O08	C06	179.6°	179.9°
N09	C07	C06	N05	125.6°	172.4°
N09	C07	C06	C30	54.7°	7.6°
C07	N09	C10	H101	30.8°	35.0°
O08	C07	C06	N05	54.7°	7.7°
O08	C07	C06	C30	124.9°	172.4°
O08	C07	N09	H091	179.5°	175.9°
C07	C06	N05	O04	0.1°	6.1°
C07	C06	N05	C30	179.7°	179.9°
C07	C06	C30	C31	17.5°	175.6°
C07	C06	C30	N35	162.0°	4.7°
C06	C07	N09	H091	0.9°	4.1°
O04	N05	C06	C30	179.8°	173.8°
N05	O04	C1	C2	90.0°	60.0°
N05	O04	C1	C3	90.0°	60.0°
N05	O04	C1	C4	90.0°	180.0°
N05	C06	C30	C31	162.8°	4.5°
N05	C06	C30	N35	17.7°	175.2°
C06	N05	O04	C1	166.1°	180.0°
C06	C30	C31	N35	179.6°	179.7°
C06	C30	C31	S32	179.7°	180.0°
C06	C30	N35	C33	179.8°	180.0°
C06	C30	C31	H311	0.3°	0.1°
C30	C31	S32	H311	180.0°	180.0°
C30	C31	S32	C33	0.0°	0.1°
C31	C30	N35	C33	0.2°	0.3°
S32	C31	C30	N35	0.1°	0.3°
C31	S32	C33	N35	0.1°	0.0°
C31	S32	C33	N34	179.8°	179.8°
C30	N35	C33	S32	0.2°	0.2°
C30	N35	C33	N34	179.9°	180.0°
N35	C30	C31	H311	179.9°	179.8°
S32	C33	N35	N34	179.7°	179.8°
C33	S32	C31	H311	180.0°	179.9°
S32	C33	N34	H341	0.0°	179.8°
S32	C33	N34	H342	120.0°	0.2°
N35	C33	N34	H341	179.7°	0.1°
N35	C33	N34	H342	59.7°	179.9°
C33	N34	H341	H342	120.0°	180.0°
H111	C11	C10	H101	64.1°	174.6°
H101	C10	N09	H091	149.2°	145.0°
O04	C1	C2	C3	90.0°	120.0°
O04	C1	C2	C4	90.0°	120.0°
O04	C1	C3	C4	90.0°	120.0°
O04	C1	C4	O1	90.0°	0.0°
O04	C1	C4	O2	90.0°	180.0°
O04	C1	C2	H1	90.0°	60.0°
O04	C1	C2	H4	90.0°	180.0°
O04	C1	C2	H5	90.0°	60.0°
O04	C1	C3	H8	90.0°	60.0°
O04	C1	C3	H9	90.0°	180.0°
O04	C1	C3	H10	90.0°	60.0°
C2	C1	C3	C4	90.0°	120.0°
C2	C1	C4	O1	90.0°	120.1°
C2	C1	C4	O2	90.0°	60.0°
C1	C2	H1	H4	90.0°	119.9°
C1	C2	H1	H5	90.0°	120.0°
C1	C2	H4	H5	90.0°	119.9°
C2	C1	C3	H8	90.0°	180.0°
C2	C1	C3	H9	90.0°	60.0°
C2	C1	C3	H10	90.0°	60.0°
C3	C1	C4	O1	90.0°	119.9°
C3	C1	C4	O2	90.0°	60.0°
C3	C1	C2	H1	90.0°	60.0°
C3	C1	C2	H4	90.0°	60.0°
C3	C1	C2	H5	90.0°	179.9°
C1	C3	H8	H9	90.0°	120.0°
C1	C3	H8	H10	90.0°	120.0°
C1	C3	H9	H10	90.0°	120.0°
C1	C4	O1	O2	90.0°	179.9°
C4	C1	C2	H1	90.0°	180.0°
C4	C1	C2	H4	90.0°	60.0°
C4	C1	C2	H5	90.0°	59.9°
C4	C1	C3	H8	90.0°	60.0°
C4	C1	C3	H9	90.0°	60.0°
C4	C1	C3	H10	90.0°	180.0°
C1	C4	O2	H11	90.0°	180.0°
O1	C4	O2	H11	90.0°	0.0°
H1	C2	H4	H5	90.0°	120.1°
H8	C3	H9	H10	90.0°	120.0°

Release date:	2025-05-14
Definition date:	2024-11-29
Last modified:	2025-05-09
Release status:	REL
Processing site:	RCSB
Derived from:	9EHY