A1C1G

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N02	C01	sing	1.47Å	1.45Å
C04	C03	sing	1.51Å	1.53Å
C05	C04	doub	1.38Å	1.39Å	Aromatic
C06	C05	sing	1.38Å	1.39Å	Aromatic
C07	C06	doub	1.38Å	1.39Å	Aromatic
C08	C07	sing	1.38Å	1.38Å	Aromatic
C09	C08	doub	1.38Å	1.39Å	Aromatic
C03	N02	sing	1.46Å	1.45Å
S10	N02	sing	1.66Å	1.71Å
O11	S10	doub	1.42Å	1.46Å
O12	S10	doub	1.42Å	1.47Å
C13	S10	sing	1.76Å	1.82Å
C14	C13	doub	1.35Å	1.39Å	Aromatic
N15	C14	sing	1.35Å	1.32Å	Aromatic
C16	N15	sing	1.38Å	1.33Å	Aromatic
O18	C17	doub	1.22Å	1.27Å
O19	C17	sing	1.35Å	1.26Å
C17	C16	sing	1.47Å	1.53Å
C20	C16	doub	1.38Å	1.39Å	Aromatic
C04	C09	sing	1.38Å	1.39Å	Aromatic
C13	C20	sing	1.40Å	1.39Å	Aromatic
C20	H201	sing	1.08Å	1.08Å
C01	H012	sing	1.09Å	1.10Å
C01	H013	sing	1.09Å	1.10Å
C01	H011	sing	1.09Å	1.10Å
C03	H031	sing	1.09Å	1.10Å
C03	H032	sing	1.09Å	1.10Å
C05	H051	sing	1.08Å	1.08Å
C06	H061	sing	1.08Å	1.08Å
C07	H071	sing	1.08Å	1.08Å
C08	H081	sing	1.08Å	1.08Å
C09	H091	sing	1.08Å	1.08Å
C14	H141	sing	1.08Å	1.08Å
N15	H151	sing	0.97Å	1.00Å
O19	H1	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C01	N02	C03	117.1°	120.0°
C01	N02	S10	116.6°	120.0°
N02	C01	H012	109.5°	109.4°
N02	C01	H013	109.5°	109.5°
N02	C01	H011	109.5°	109.4°
C03	C04	C05	121.2°	120.0°
C04	C03	N02	115.7°	109.5°
C03	C04	C09	119.3°	119.9°
C04	C03	H031	107.9°	109.4°
C04	C03	H032	107.9°	109.5°
C04	C05	C06	120.1°	120.0°
C05	C04	C09	119.5°	120.1°
C04	C05	H051	119.9°	120.0°
C05	C06	C07	120.2°	120.1°
C06	C05	H051	120.0°	120.0°
C05	C06	H061	119.9°	120.0°
C06	C07	C08	119.7°	120.0°
C07	C06	H061	119.9°	120.0°
C06	C07	H071	120.2°	120.0°
C07	C08	C09	120.0°	120.0°
C08	C07	H071	120.1°	120.0°
C07	C08	H081	120.0°	120.0°
C08	C09	C04	120.5°	120.0°
C09	C08	H081	120.0°	120.0°
C08	C09	H091	119.7°	120.0°
C03	N02	S10	115.3°	120.0°
N02	C03	H031	107.9°	109.5°
N02	C03	H032	107.9°	109.5°
N02	S10	O11	109.4°	106.4°
N02	S10	O12	113.8°	106.4°
N02	S10	C13	108.7°	107.2°
O11	S10	O12	102.2°	123.2°
O11	S10	C13	110.7°	106.4°
O12	S10	C13	111.9°	106.4°
S10	C13	C14	127.2°	126.1°
S10	C13	C20	126.4°	126.1°
C13	C14	N15	108.5°	109.0°
C14	C13	C20	106.4°	107.9°
C13	C14	H141	125.8°	125.6°
C14	N15	C16	110.1°	108.7°
N15	C14	H141	125.7°	125.4°
C14	N15	H151	124.9°	125.7°
N15	C16	C17	126.4°	126.2°
N15	C16	C20	108.6°	107.5°
C16	N15	H151	125.0°	125.6°
O18	C17	O19	121.0°	120.0°
O18	C17	C16	119.3°	120.0°
O19	C17	C16	119.6°	120.0°
C17	O19	H1	109.5°	117.0°
C17	C16	C20	125.1°	126.3°
C16	C20	C13	106.4°	107.0°
C16	C20	H201	126.8°	126.5°
C04	C09	H091	119.7°	120.1°
C13	C20	H201	126.8°	126.5°
H012	C01	H013	109.5°	109.5°
H012	C01	H011	109.4°	109.5°
H013	C01	H011	109.5°	109.5°
H031	C03	H032	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C01	N02	C03	C04	100.2°	84.9°
C01	N02	C03	S10	143.0°	180.0°
C01	N02	S10	O11	169.6°	156.5°
C01	N02	S10	O12	56.0°	23.5°
C01	N02	S10	C13	69.4°	90.0°
N02	C01	H012	H013	120.0°	120.0°
N02	C01	H012	H011	120.0°	119.9°
N02	C01	H013	H011	120.0°	120.0°
C01	N02	C03	H031	138.9°	35.0°
C01	N02	C03	H032	20.7°	155.0°
C03	C04	C05	C09	179.2°	179.7°
C03	C04	C05	C06	179.8°	180.0°
C03	C04	C09	C08	179.3°	179.7°
C04	C03	N02	H031	120.9°	120.0°
C04	C03	N02	H032	120.9°	120.1°
C04	C03	N02	S10	116.8°	95.0°
C04	C03	H031	H032	117.2°	120.0°
C03	C04	C05	H051	0.2°	0.1°
C03	C04	C09	H091	0.7°	0.1°
C04	C05	C06	H051	180.0°	179.9°
C04	C05	C06	C07	1.0°	0.0°
C05	C04	C09	C08	0.1°	0.6°
C05	C04	C03	N02	43.0°	89.7°
C05	C04	C03	H031	77.9°	30.3°
C05	C04	C03	H032	163.9°	150.3°
C04	C05	C06	H061	179.0°	179.9°
C05	C04	C09	H091	179.9°	179.7°
C05	C06	C07	H061	180.0°	180.0°
C05	C06	C07	C08	1.0°	0.0°
C06	C05	C04	C09	0.5°	0.3°
C05	C06	C07	H071	179.0°	180.0°
C06	C07	C08	H071	180.0°	179.9°
C06	C07	C08	C09	0.6°	0.2°
C07	C06	C05	H051	179.0°	179.9°
C06	C07	C08	H081	179.4°	180.0°
C07	C08	C09	H081	180.0°	179.8°
C07	C08	C09	C04	0.1°	0.6°
C08	C07	C06	H061	179.0°	180.0°
C07	C08	C09	H091	179.9°	179.8°
C08	C09	C04	H091	180.0°	179.6°
C09	C08	C07	H071	179.5°	179.7°
C03	N02	S10	O11	47.2°	23.6°
C03	N02	S10	O12	160.8°	156.5°
C03	N02	S10	C13	73.8°	90.0°
N02	C03	C04	C09	137.8°	90.0°
C03	N02	C01	H012	180.0°	90.0°
C03	N02	C01	H013	60.0°	150.0°
C03	N02	C01	H011	60.0°	29.9°
N02	C03	H031	H032	117.2°	120.0°
N02	S10	O11	O12	120.9°	123.0°
N02	S10	O11	C13	119.8°	114.1°
N02	S10	O12	C13	123.7°	114.1°
N02	S10	C13	C14	158.3°	90.3°
N02	S10	C13	C20	21.5°	89.9°
S10	N02	C01	H012	37.5°	90.0°
S10	N02	C01	H013	82.5°	30.0°
S10	N02	C01	H011	157.5°	150.0°
S10	N02	C03	H031	4.1°	145.0°
S10	N02	C03	H032	122.3°	25.0°
O11	S10	O12	C13	118.5°	122.9°
O11	S10	C13	C14	38.1°	23.3°
O11	S10	C13	C20	141.7°	156.5°
O12	S10	C13	C14	75.2°	156.2°
O12	S10	C13	C20	105.0°	23.6°
S10	C13	C14	C20	179.9°	179.8°
S10	C13	C14	N15	179.9°	180.0°
S10	C13	C20	C16	179.9°	180.0°
S10	C13	C20	H201	0.1°	0.0°
S10	C13	C14	H141	0.2°	0.0°
C13	C14	N15	H141	180.0°	180.0°
C13	C14	N15	C16	0.0°	0.1°
C14	C13	C20	C16	0.0°	0.2°
C14	C13	C20	H201	180.0°	179.8°
C13	C14	N15	H151	180.0°	180.0°
C14	N15	C16	H151	180.0°	179.9°
C14	N15	C16	C17	179.4°	179.8°
C14	N15	C16	C20	0.0°	0.1°
N15	C14	C13	C20	0.0°	0.2°
N15	C16	C17	O18	128.7°	179.8°
N15	C16	C17	O19	51.2°	0.2°
N15	C16	C17	C20	179.4°	179.7°
N15	C16	C20	C13	0.0°	0.2°
N15	C16	C20	H201	180.0°	179.8°
C16	N15	C14	H141	180.0°	179.9°
O18	C17	O19	C16	179.8°	180.0°
O18	C17	C16	C20	50.7°	0.1°
O18	C17	O19	H1	0.0°	0.1°
O19	C17	C16	C20	129.4°	180.0°
C17	C16	C20	C13	179.5°	180.0°
C17	C16	C20	H201	0.5°	0.0°
C17	C16	N15	H151	0.5°	0.0°
C16	C17	O19	H1	179.9°	179.9°
C16	C20	C13	H201	180.0°	180.0°
C20	C16	N15	H151	180.0°	179.8°
C09	C04	C03	H031	101.4°	150.0°
C09	C04	C03	H032	16.9°	30.0°
C09	C04	C05	H051	179.5°	179.8°
C04	C09	C08	H081	179.9°	179.7°
C20	C13	C14	H141	180.0°	179.8°
H012	C01	H013	H011	120.0°	120.0°
H051	C05	C06	H061	1.0°	0.1°
H061	C06	C07	H071	1.0°	0.1°
H071	C07	C08	H081	0.6°	0.1°
H081	C08	C09	H091	0.1°	0.0°
H141	C14	N15	H151	0.0°	0.0°

Release date:	2026-08-26
Definition date:	2025-11-21
Last modified:	2026-08-21
Release status:	REL
Processing site:	RCSB
Derived from:	13TL