A1CZX

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C02	O01	doub	1.21Å	1.22Å
C04	C03	doub	1.40Å	1.42Å	Aromatic
C05	C04	sing	1.38Å	1.40Å	Aromatic
C06	C05	doub	1.38Å	1.40Å	Aromatic
N07	C06	sing	1.32Å	1.35Å	Aromatic
C08	N07	doub	1.32Å	1.36Å	Aromatic
C03	C02	sing	1.48Å	1.54Å
N09	C02	sing	1.35Å	1.44Å
C10	N09	sing	1.47Å	1.49Å
C11	C10	sing	1.47Å	1.59Å
C12	C11	trip	1.17Å	1.20Å
C13	C12	sing	1.47Å	1.46Å
N14	C13	sing	1.47Å	1.47Å
C16	C15	doub	1.39Å	1.38Å	Aromatic
C17	C16	sing	1.38Å	1.40Å	Aromatic
C18	C17	doub	1.38Å	1.36Å	Aromatic
C19	C18	sing	1.38Å	1.41Å	Aromatic
C20	C19	doub	1.38Å	1.39Å	Aromatic
C15	N14	sing	1.40Å	1.43Å
C21	N14	sing	1.35Å	1.40Å
C23	C22	sing	1.51Å	1.48Å
C24	C23	doub	1.38Å	1.38Å	Aromatic
C25	C24	sing	1.38Å	1.37Å	Aromatic
C26	C25	doub	1.38Å	1.38Å	Aromatic
F28	C27	sing	1.40Å	1.35Å
F29	C27	sing	1.40Å	1.33Å
F30	C27	sing	1.40Å	1.35Å
C27	C26	sing	1.51Å	1.50Å
C31	C26	sing	1.38Å	1.38Å	Aromatic
C32	C31	doub	1.38Å	1.40Å	Aromatic
C33	C32	sing	1.51Å	1.51Å
F34	C33	sing	1.40Å	1.34Å
F35	C33	sing	1.40Å	1.34Å
F36	C33	sing	1.40Å	1.34Å
C22	C21	sing	1.51Å	1.52Å
O37	C21	doub	1.21Å	1.23Å
C03	C08	sing	1.40Å	1.41Å	Aromatic
C15	C20	sing	1.39Å	1.40Å	Aromatic
C23	C32	sing	1.38Å	1.40Å	Aromatic
C10	H101	sing	1.09Å	1.10Å
C10	H102	sing	1.09Å	1.10Å
C13	H131	sing	1.09Å	1.10Å
C13	H132	sing	1.09Å	1.10Å
C04	H041	sing	1.08Å	1.08Å
C05	H051	sing	1.08Å	1.08Å
C06	H061	sing	1.08Å	1.08Å
C08	H081	sing	1.08Å	1.08Å
C16	H161	sing	1.08Å	1.08Å
C17	H171	sing	1.08Å	1.08Å
C18	H181	sing	1.08Å	1.08Å
C19	H191	sing	1.08Å	1.08Å
C20	H201	sing	1.08Å	1.08Å
C22	H221	sing	1.09Å	1.10Å
C22	H222	sing	1.09Å	1.10Å
C24	H241	sing	1.08Å	1.08Å
C25	H251	sing	1.08Å	1.08Å
C31	H311	sing	1.08Å	1.08Å
N09	H091	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O01	C02	C03	119.4°	120.0°
O01	C02	N09	117.5°	120.0°
C03	C04	C05	121.4°	118.3°
C04	C03	C02	124.1°	120.6°
C04	C03	C08	114.1°	118.9°
C03	C04	H041	119.3°	120.9°
C04	C05	C06	119.0°	119.3°
C05	C04	H041	119.3°	120.8°
C04	C05	H051	120.5°	120.4°
C05	C06	N07	122.0°	121.1°
C06	C05	H051	120.5°	120.3°
C05	C06	H061	119.0°	119.5°
C06	N07	C08	117.3°	121.9°
N07	C06	H061	119.0°	119.4°
N07	C08	C03	126.1°	120.6°
N07	C08	H081	116.9°	119.7°
C03	C02	N09	123.1°	120.0°
C02	C03	C08	121.8°	120.6°
C02	N09	C10	131.0°	120.0°
C02	N09	H091	114.5°	120.0°
N09	C10	C11	118.0°	109.4°
N09	C10	H101	107.3°	109.4°
N09	C10	H102	107.3°	109.5°
C10	N09	H091	114.5°	120.0°
C10	C11	C12	177.6°	180.0°
C11	C10	H101	107.3°	109.5°
C11	C10	H102	107.3°	109.5°
C11	C12	C13	179.0°	180.0°
C12	C13	N14	110.0°	109.4°
C12	C13	H131	109.4°	109.5°
C12	C13	H132	109.3°	109.4°
C13	N14	C15	117.6°	120.0°
C13	N14	C21	121.2°	120.0°
N14	C13	H131	109.3°	109.5°
N14	C13	H132	109.4°	109.5°
C15	C16	C17	120.8°	119.9°
C16	C15	N14	123.3°	120.0°
C16	C15	C20	120.6°	119.9°
C15	C16	H161	119.6°	120.0°
C16	C17	C18	119.7°	120.1°
C17	C16	H161	119.6°	120.1°
C16	C17	H171	120.1°	120.0°
C17	C18	C19	119.7°	120.1°
C18	C17	H171	120.1°	119.9°
C17	C18	H181	120.2°	119.9°
C18	C19	C20	121.5°	120.1°
C19	C18	H181	120.1°	120.0°
C18	C19	H191	119.3°	120.0°
C19	C20	C15	117.7°	119.9°
C20	C19	H191	119.3°	119.9°
C19	C20	H201	121.1°	120.1°
C15	N14	C21	121.2°	120.0°
N14	C15	C20	116.1°	120.1°
N14	C21	C22	120.5°	120.0°
N14	C21	O37	120.2°	120.0°
C22	C23	C24	119.7°	120.0°
C23	C22	C21	110.7°	109.5°
C22	C23	C32	122.5°	120.0°
C23	C22	H221	109.2°	109.5°
C23	C22	H222	109.1°	109.5°
C23	C24	C25	120.8°	120.0°
C24	C23	C32	117.9°	120.0°
C23	C24	H241	119.6°	120.0°
C24	C25	C26	121.2°	120.0°
C25	C24	H241	119.6°	120.0°
C24	C25	H251	119.4°	120.0°
C25	C26	C27	119.2°	120.0°
C25	C26	C31	119.8°	120.0°
C26	C25	H251	119.4°	120.0°
F28	C27	F29	106.1°	109.5°
F28	C27	F30	105.9°	109.5°
F28	C27	C26	111.1°	109.5°
F29	C27	F30	104.2°	109.5°
F29	C27	C26	116.4°	109.4°
F30	C27	C26	112.2°	109.5°
C27	C26	C31	120.9°	120.0°
C26	C31	C32	118.6°	120.0°
C26	C31	H311	120.7°	120.0°
C31	C32	C33	117.3°	120.0°
C31	C32	C23	121.7°	120.0°
C32	C31	H311	120.7°	120.0°
C32	C33	F34	118.6°	109.5°
C32	C33	F35	114.0°	109.5°
C32	C33	F36	108.0°	109.5°
C33	C32	C23	121.0°	120.0°
F34	C33	F35	102.7°	109.4°
F34	C33	F36	106.8°	109.5°
F35	C33	F36	105.8°	109.4°
C22	C21	O37	119.3°	120.0°
C21	C22	H221	109.1°	109.4°
C21	C22	H222	109.2°	109.5°
C03	C08	H081	117.0°	119.7°
C15	C20	H201	121.2°	120.0°
H101	C10	H102	109.5°	109.5°
H131	C13	H132	109.4°	109.5°
H221	C22	H222	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O01	C02	C03	C04	15.8°	0.2°
O01	C02	C03	N09	179.9°	180.0°
O01	C02	N09	C10	0.7°	0.0°
O01	C02	C03	C08	164.4°	180.0°
O01	C02	N09	H091	179.3°	179.9°
C03	C04	C05	H041	180.0°	179.9°
C03	C04	C05	C06	0.0°	0.0°
C04	C03	C08	N07	0.1°	0.6°
C04	C03	C02	C08	179.7°	179.8°
C04	C03	C02	N09	164.1°	179.8°
C03	C04	C05	H051	180.0°	180.0°
C04	C03	C08	H081	179.9°	179.7°
C04	C05	C06	H051	180.0°	180.0°
C04	C05	C06	N07	0.0°	0.0°
C05	C04	C03	C02	179.8°	180.0°
C05	C04	C03	C08	0.1°	0.3°
C04	C05	C06	H061	179.9°	180.0°
C05	C06	N07	H061	180.0°	180.0°
C05	C06	N07	C08	0.0°	0.3°
C06	C05	C04	H041	180.0°	179.9°
C06	N07	C08	C03	0.1°	0.6°
N07	C06	C05	H051	180.0°	180.0°
C06	N07	C08	H081	180.0°	179.7°
N07	C08	C03	C02	179.9°	179.7°
N07	C08	C03	H081	180.0°	179.7°
C08	N07	C06	H061	180.0°	179.7°
C03	C02	N09	C10	179.2°	180.0°
C02	C03	C04	H041	0.2°	0.0°
C02	C03	C08	H081	0.2°	0.0°
C03	C02	N09	H091	0.8°	0.1°
C02	N09	C10	H091	180.0°	179.9°
C02	N09	C10	C11	64.1°	180.0°
N09	C02	C03	C08	15.6°	0.0°
C02	N09	C10	H101	57.1°	60.0°
C02	N09	C10	H102	174.6°	60.0°
N09	C10	C11	H101	121.2°	119.9°
N09	C10	C11	H102	121.2°	120.0°
N09	C10	C11	C12	8.3°	138.9°
N09	C10	H101	H102	116.1°	120.0°
C10	C11	C12	C13	51.9°	91.9°
C11	C10	H101	H102	116.1°	120.1°
C11	C10	N09	H091	115.9°	0.1°
C11	C12	C13	N14	49.6°	170.8°
C12	C11	C10	H101	112.9°	101.1°
C12	C11	C10	H102	129.5°	19.0°
C11	C12	C13	H131	70.5°	50.8°
C11	C12	C13	H132	169.7°	69.2°
C12	C13	N14	H131	120.1°	120.0°
C12	C13	N14	H132	120.1°	120.0°
C12	C13	N14	C15	67.2°	90.1°
C12	C13	N14	C21	113.6°	90.0°
C12	C13	H131	H132	119.7°	120.0°
C13	N14	C15	C16	79.9°	111.5°
C13	N14	C15	C21	179.2°	179.9°
C13	N14	C21	C22	178.7°	175.6°
C13	N14	C21	O37	0.2°	4.4°
C13	N14	C15	C20	100.4°	68.2°
N14	C13	H131	H132	119.8°	120.0°
C15	C16	C17	H161	180.0°	180.0°
C15	C16	C17	C18	0.1°	0.0°
C16	C15	C20	C19	0.1°	0.6°
C16	C15	N14	C20	179.8°	179.7°
C16	C15	N14	C21	99.3°	68.5°
C15	C16	C17	H171	179.9°	180.0°
C16	C15	C20	H201	179.9°	179.7°
C16	C17	C18	H171	180.0°	179.9°
C16	C17	C18	C19	0.0°	0.0°
C17	C16	C15	N14	179.7°	180.0°
C17	C16	C15	C20	0.0°	0.3°
C16	C17	C18	H181	179.9°	180.0°
C17	C18	C19	H181	180.0°	180.0°
C17	C18	C19	C20	0.1°	0.3°
C18	C17	C16	H161	179.9°	180.0°
C17	C18	C19	H191	179.9°	180.0°
C18	C19	C20	H191	180.0°	179.7°
C18	C19	C20	C15	0.2°	0.6°
C19	C18	C17	H171	179.9°	179.9°
C18	C19	C20	H201	179.8°	179.7°
C19	C20	C15	N14	179.6°	179.7°
C19	C20	C15	H201	180.0°	179.7°
C20	C19	C18	H181	179.9°	179.7°
C15	N14	C21	C22	0.4°	4.4°
C15	N14	C21	O37	179.4°	175.6°
C15	N14	C13	H131	52.9°	29.9°
C15	N14	C13	H132	172.7°	150.0°
N14	C15	C16	H161	0.2°	0.0°
N14	C15	C20	H201	0.4°	0.0°
N14	C21	C22	C23	149.5°	174.6°
N14	C21	C22	O37	178.9°	180.0°
C21	N14	C15	C20	80.4°	111.8°
C21	N14	C13	H131	126.3°	150.0°
C21	N14	C13	H132	6.5°	30.0°
N14	C21	C22	H221	29.3°	54.6°
N14	C21	C22	H222	90.3°	65.4°
C22	C23	C24	C32	179.1°	179.8°
C22	C23	C24	C25	179.7°	179.9°
C22	C23	C32	C31	179.9°	179.7°
C22	C23	C32	C33	1.4°	0.1°
C23	C22	C21	H221	120.2°	120.0°
C23	C22	C21	H222	120.2°	120.0°
C23	C22	C21	O37	29.5°	5.4°
C23	C22	H221	H222	119.4°	120.0°
C22	C23	C24	H241	0.2°	0.1°
C23	C24	C25	H241	180.0°	180.0°
C23	C24	C25	C26	0.3°	0.1°
C24	C23	C32	C31	0.9°	0.4°
C24	C23	C32	C33	179.6°	179.7°
C24	C23	C22	C21	98.7°	94.8°
C24	C23	C22	H221	141.1°	145.3°
C24	C23	C22	H222	21.5°	25.2°
C23	C24	C25	H251	179.7°	180.0°
C24	C25	C26	H251	180.0°	179.9°
C24	C25	C26	C27	180.0°	180.0°
C24	C25	C26	C31	0.1°	0.0°
C25	C24	C23	C32	0.7°	0.3°
C25	C26	C27	F28	111.7°	0.1°
C25	C26	C27	F29	126.7°	120.1°
C25	C26	C27	F30	6.7°	119.9°
C25	C26	C27	C31	179.9°	179.9°
C25	C26	C31	C32	0.3°	0.2°
C26	C25	C24	H241	179.7°	180.0°
C25	C26	C31	H311	179.7°	180.0°
F28	C27	F29	F30	111.6°	120.0°
F28	C27	F29	C26	124.2°	120.0°
F28	C27	F30	C26	121.4°	120.0°
F28	C27	C26	C31	68.4°	180.0°
F29	C27	F30	C26	126.8°	120.0°
F29	C27	C26	C31	53.2°	60.0°
F30	C27	C26	C31	173.2°	60.0°
C27	C26	C31	C32	179.8°	179.8°
C27	C26	C25	H251	0.0°	0.1°
C27	C26	C31	H311	0.2°	0.0°
C26	C31	C32	H311	180.0°	179.8°
C26	C31	C32	C33	179.5°	179.8°
C26	C31	C32	C23	0.7°	0.4°
C31	C26	C25	H251	179.9°	180.0°
C31	C32	C33	C23	178.8°	179.8°
C31	C32	C33	F34	123.3°	0.3°
C31	C32	C33	F35	2.2°	120.2°
C31	C32	C33	F36	115.1°	119.8°
C32	C33	F34	F35	126.7°	120.0°
C32	C33	F34	F36	122.2°	120.0°
C32	C33	F35	F36	118.5°	120.0°
C33	C32	C31	H311	0.6°	0.1°
F34	C33	F35	F36	111.8°	120.0°
F34	C33	C32	C23	55.4°	179.9°
F35	C33	C32	C23	176.6°	59.9°
F36	C33	C32	C23	66.2°	60.0°
C21	C22	C23	C32	80.3°	85.0°
C21	C22	H221	H222	119.4°	120.0°
O37	C21	C22	H221	149.7°	125.4°
O37	C21	C22	H222	90.7°	114.6°
C08	C03	C04	H041	179.9°	179.8°
C20	C15	C16	H161	180.0°	179.7°
C15	C20	C19	H191	179.8°	179.7°
C32	C23	C22	H221	39.9°	34.9°
C32	C23	C22	H222	159.5°	155.0°
C32	C23	C24	H241	179.3°	179.8°
C23	C32	C31	H311	179.3°	179.8°
H101	C10	N09	H091	122.9°	120.1°
H102	C10	N09	H091	5.4°	119.9°
H041	C04	C05	H051	0.0°	0.1°
H051	C05	C06	H061	0.1°	0.0°
H161	C16	C17	H171	0.1°	0.1°
H171	C17	C18	H181	0.1°	0.0°
H181	C18	C19	H191	0.1°	0.0°
H191	C19	C20	H201	0.2°	0.0°
H241	C24	C25	H251	0.4°	0.0°

Release date:	2026-05-20
Definition date:	2025-11-05
Last modified:	2026-05-15
Release status:	REL
Processing site:	RCSB
Derived from:	9YSH