WFZ

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N	C02	sing	1.40Å	1.36Å
C03	N04	doub	1.30Å	1.33Å	Aromatic
N04	C05	sing	1.32Å	1.39Å	Aromatic
C06	N07	doub	1.32Å	1.35Å	Aromatic
N07	C08	sing	1.33Å	1.35Å	Aromatic
C09	N10	doub	1.30Å	1.31Å	Aromatic
N10	C11	sing	1.32Å	1.39Å	Aromatic
O13	C14	sing	1.45Å	1.45Å
C12	O13	sing	1.35Å	1.34Å
C12	O15	doub	1.21Å	1.21Å
C11	C12	sing	1.47Å	1.48Å
C11	C16	doub	1.37Å	1.36Å	Aromatic
C16	S17	sing	1.71Å	1.70Å	Aromatic
C08	C09	sing	1.48Å	1.47Å
C08	C18	doub	1.40Å	1.39Å	Aromatic
C18	C19	sing	1.38Å	1.38Å	Aromatic
C19	C20	doub	1.40Å	1.40Å	Aromatic
C20	C	sing	1.47Å	1.51Å
C	O22	sing	1.35Å	1.24Å
C	O	doub	1.21Å	1.24Å
C05	C06	sing	1.48Å	1.46Å
C05	C24	doub	1.35Å	1.36Å	Aromatic
C24	S25	sing	1.71Å	1.70Å	Aromatic
C02	C03	sing	1.48Å	1.40Å
C02	C26	doub	1.34Å	1.33Å
C03	S25	sing	1.76Å	1.74Å	Aromatic
C06	C20	sing	1.41Å	1.41Å	Aromatic
C09	S17	sing	1.76Å	1.74Å	Aromatic
N	H011	sing	0.97Å	1.00Å
N	H012	sing	0.97Å	1.00Å
C14	H141	sing	1.09Å	1.10Å
C14	H142	sing	1.09Å	1.10Å
C14	H143	sing	1.09Å	1.10Å
C16	H161	sing	1.08Å	1.08Å
C18	H181	sing	1.08Å	1.08Å
C19	H191	sing	1.08Å	1.08Å
C24	H241	sing	1.08Å	1.08Å
C26	H261	sing	1.08Å	1.08Å
C26	H262	sing	1.08Å	1.08Å
O22	H1	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N	C02	C03	117.5°	120.0°
N	C02	C26	118.9°	120.0°
C02	N	H011	109.5°	120.0°
C02	N	H012	109.5°	120.0°
C03	N04	C05	109.4°	115.8°
N04	C03	C02	123.6°	125.4°
N04	C03	S25	113.2°	109.2°
N04	C05	C06	120.6°	122.4°
N04	C05	C24	113.3°	115.3°
C06	N07	C08	120.0°	121.6°
N07	C06	C05	116.1°	119.7°
N07	C06	C20	121.1°	120.4°
N07	C08	C09	115.4°	119.5°
N07	C08	C18	121.9°	121.0°
C09	N10	C11	108.4°	116.0°
N10	C09	C08	125.4°	125.2°
N10	C09	S17	113.6°	109.5°
N10	C11	C12	118.3°	122.6°
N10	C11	C16	115.3°	114.9°
C14	O13	C12	117.4°	117.0°
O13	C14	H141	109.5°	109.5°
O13	C14	H142	109.4°	109.5°
O13	C14	H143	109.4°	109.4°
O13	C12	O15	125.0°	120.0°
O13	C12	C11	111.9°	120.0°
O15	C12	C11	123.1°	120.0°
C12	C11	C16	126.4°	122.6°
C11	C16	S17	109.9°	109.0°
C11	C16	H161	125.1°	125.5°
C16	S17	C09	88.9°	90.7°
S17	C16	H161	125.0°	125.5°
C09	C08	C18	122.6°	119.5°
C08	C09	S17	121.0°	125.3°
C08	C18	C19	118.6°	119.5°
C08	C18	H181	120.7°	120.3°
C18	C19	C20	120.0°	118.5°
C19	C18	H181	120.7°	120.2°
C18	C19	H191	120.0°	120.8°
C19	C20	C	119.6°	120.5°
C19	C20	C06	118.3°	119.0°
C20	C19	H191	120.0°	120.8°
C20	C	O22	117.8°	120.0°
C20	C	O	117.8°	120.0°
C	C20	C06	122.0°	120.5°
O22	C	O	124.4°	120.0°
C	O22	H1	109.5°	117.0°
C06	C05	C24	126.0°	122.4°
C05	C06	C20	122.7°	119.8°
C05	C24	S25	111.1°	109.2°
C05	C24	H241	124.4°	125.4°
C24	S25	C03	89.0°	90.5°
S25	C24	H241	124.4°	125.4°
C03	C02	C26	123.6°	120.0°
C02	C03	S25	123.2°	125.4°
C02	C26	H261	120.0°	120.0°
C02	C26	H262	120.0°	120.0°
H011	N	H012	109.5°	120.0°
H141	C14	H142	109.5°	109.5°
H141	C14	H143	109.5°	109.5°
H142	C14	H143	109.5°	109.4°
H261	C26	H262	120.0°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N	C02	C03	N04	41.8°	180.0°
N	C02	C03	C26	179.6°	179.9°
N	C02	C03	S25	137.4°	0.4°
C02	N	H011	H012	120.0°	179.6°
N	C02	C26	H261	179.6°	180.0°
N	C02	C26	H262	0.4°	0.1°
C03	N04	C05	C06	159.5°	180.0°
C03	N04	C05	C24	21.6°	0.0°
N04	C03	S25	C24	8.0°	0.4°
N04	C03	C02	S25	179.1°	179.6°
N04	C03	C02	C26	138.6°	0.1°
N04	C05	C06	N07	118.2°	114.0°
N04	C05	C06	C24	178.8°	179.9°
N04	C05	C24	S25	15.8°	0.3°
C05	N04	C03	C02	161.4°	179.9°
C05	N04	C03	S25	17.8°	0.3°
N04	C05	C06	C20	62.9°	66.2°
N04	C05	C24	H241	164.2°	180.0°
C06	N07	C08	C09	179.9°	180.0°
C06	N07	C08	C18	0.2°	0.0°
N07	C06	C20	C19	0.6°	0.5°
N07	C06	C20	C	179.7°	179.7°
N07	C06	C05	C20	178.9°	179.8°
N07	C06	C05	C24	60.5°	66.0°
N07	C08	C09	N10	160.8°	0.0°
N07	C08	C09	C18	179.9°	180.0°
N07	C08	C18	C19	0.0°	0.0°
C08	N07	C06	C05	179.4°	180.0°
C08	N07	C06	C20	0.5°	0.2°
N07	C08	C09	S17	19.5°	179.7°
N07	C08	C18	H181	180.0°	180.0°
C09	N10	C11	C12	165.1°	180.0°
C09	N10	C11	C16	14.9°	0.0°
N10	C09	S17	C16	17.8°	0.3°
N10	C09	C08	S17	179.6°	179.7°
N10	C09	C08	C18	19.3°	180.0°
N10	C11	C12	O13	152.1°	0.0°
N10	C11	C12	O15	27.9°	180.0°
N10	C11	C12	C16	180.0°	180.0°
N10	C11	C16	S17	1.8°	0.3°
C11	N10	C09	C08	158.4°	180.0°
C11	N10	C09	S17	21.2°	0.2°
N10	C11	C16	H161	178.2°	179.9°
C14	O13	C12	O15	1.3°	0.0°
C14	O13	C12	C11	178.7°	180.0°
O13	C14	H141	H142	120.0°	120.1°
O13	C14	H141	H143	119.9°	120.0°
O13	C14	H142	H143	120.0°	119.9°
O13	C12	O15	C11	180.0°	180.0°
O13	C12	C11	C16	27.9°	180.0°
C12	O13	C14	H141	180.0°	59.9°
C12	O13	C14	H142	60.0°	180.0°
C12	O13	C14	H143	60.0°	60.0°
O15	C12	C11	C16	152.1°	0.0°
C12	C11	C16	S17	178.2°	179.7°
C12	C11	C16	H161	1.8°	0.1°
C11	C16	S17	H161	180.0°	179.8°
C11	C16	S17	C09	8.3°	0.3°
C16	S17	C09	C08	161.9°	179.9°
C09	C08	C18	C19	179.9°	180.0°
C09	C08	C18	H181	0.1°	0.0°
C08	C18	C19	H181	180.0°	180.0°
C08	C18	C19	C20	0.1°	0.3°
C18	C08	C09	S17	160.4°	0.3°
C08	C18	C19	H191	179.9°	180.0°
C18	C19	C20	H191	180.0°	179.7°
C18	C19	C20	C	179.9°	179.7°
C18	C19	C20	C06	0.4°	0.5°
C19	C20	C	C06	179.7°	179.8°
C19	C20	C	O22	71.0°	5.7°
C19	C20	C	O	109.1°	174.2°
C19	C20	C06	C05	179.4°	179.8°
C20	C19	C18	H181	179.9°	179.8°
C20	C	O22	O	179.9°	179.9°
C	C20	C06	C05	0.9°	0.0°
C	C20	C19	H191	0.1°	0.1°
C20	C	O22	H1	179.9°	180.0°
O22	C	C20	C06	108.7°	174.0°
O	C	C20	C06	71.2°	6.0°
O	C	O22	H1	0.0°	0.1°
C06	C05	C24	S25	165.4°	179.8°
C06	C05	C24	H241	14.6°	0.1°
C05	C24	S25	H241	180.0°	179.7°
C05	C24	S25	C03	4.6°	0.4°
C24	C05	C06	C20	118.3°	113.7°
C24	S25	C03	C02	171.3°	180.0°
C03	C02	N	H011	180.0°	0.1°
C03	C02	N	H012	60.0°	179.7°
C03	C02	C26	H261	0.0°	0.1°
C03	C02	C26	H262	180.0°	180.0°
C26	C02	C03	S25	42.2°	179.7°
C26	C02	N	H011	0.4°	180.0°
C26	C02	N	H012	120.4°	0.4°
C02	C26	H261	H262	180.0°	179.9°
C03	S25	C24	H241	175.4°	180.0°
C06	C20	C19	H191	179.6°	179.8°
C09	S17	C16	H161	171.7°	179.9°
H141	C14	H142	H143	120.0°	120.0°
H181	C18	C19	H191	0.1°	0.1°

Release date:	2024-03-27
Definition date:	2023-10-03
Last modified:	2024-03-22
Release status:	REL
Processing site:	PDBJ
Derived from:	8WM0