G4S

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.53Å	1.53Å
C1	O1	sing	1.43Å	1.39Å
C1	O5	sing	1.43Å	1.43Å
C1	H1	sing	1.10Å	1.12Å
C2	C3	sing	1.53Å	1.52Å
C2	O2	sing	1.43Å	1.42Å
C2	H2	sing	1.10Å	1.11Å
C3	C4	sing	1.53Å	1.52Å
C3	O3	sing	1.43Å	1.43Å
C3	H3	sing	1.10Å	1.12Å
C4	C5	sing	1.53Å	1.52Å
C4	O4	sing	1.43Å	1.43Å
C4	H4	sing	1.10Å	1.11Å
C5	C6	sing	1.52Å	1.51Å
C5	O5	sing	1.43Å	1.44Å
C5	H5	sing	1.10Å	1.12Å
C6	O6	sing	1.42Å	1.43Å
C6	H61	sing	1.09Å	1.11Å
C6	H62	sing	1.09Å	1.11Å
O1	HO1	sing	0.97Å	0.95Å
O2	HO2	sing	0.97Å	0.95Å
O3	HO3	sing	0.97Å	0.95Å
O4	S	sing	1.63Å	1.60Å
O6	HO6	sing	0.97Å	0.95Å
S	O7	doub	1.45Å	1.45Å
S	O8	doub	1.45Å	1.45Å
S	O9	sing	1.63Å	1.45Å
HO4	O9	sing	0.99Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	O1	108.4°	110.1°
C2	C1	O5	109.3°	111.0°
C2	C1	H1	109.5°	110.8°
C1	C2	C3	110.5°	110.7°
C1	C2	O2	109.2°	108.4°
C1	C2	H2	109.5°	110.8°
O1	C1	O5	107.3°	109.9°
O1	C1	H1	111.5°	106.0°
C1	O1	HO1	108.4°	106.4°
O5	C1	H1	110.6°	109.0°
C1	O5	C5	112.3°	113.1°
C3	C2	O2	111.0°	109.3°
C3	C2	H2	107.7°	110.5°
C2	C3	C4	110.4°	111.1°
C2	C3	O3	109.6°	109.3°
C2	C3	H3	108.8°	109.3°
O2	C2	H2	109.0°	107.0°
C2	O2	HO2	109.3°	106.5°
C4	C3	O3	109.7°	110.3°
C4	C3	H3	108.8°	110.0°
C3	C4	C5	110.2°	109.8°
C3	C4	O4	110.4°	108.5°
C3	C4	H4	108.0°	109.9°
O3	C3	H3	109.5°	106.8°
C3	O3	HO3	109.6°	106.6°
C5	C4	O4	108.6°	110.0°
C5	C4	H4	109.9°	111.3°
C4	C5	C6	112.7°	112.9°
C4	C5	O5	110.3°	109.9°
C4	C5	H5	105.9°	109.8°
O4	C4	H4	109.7°	107.2°
C4	O4	S	116.0°	119.6°
C6	C5	O5	106.9°	107.3°
C6	C5	H5	109.4°	108.1°
C5	C6	O6	111.1°	108.6°
C5	C6	H61	111.6°	110.0°
C5	C6	H62	111.6°	110.0°
O5	C5	H5	111.8°	108.6°
O6	C6	H61	111.6°	109.2°
O6	C6	H62	111.6°	109.3°
C6	O6	HO6	111.2°	107.0°
H61	C6	H62	98.8°	109.6°
O4	S	O7	109.5°	107.3°
O4	S	O8	109.5°	109.1°
O4	S	O9	109.5°	103.7°
O7	S	O8	109.4°	120.1°
O7	S	O9	109.5°	107.5°
O8	S	O9	109.5°	107.9°
S	O9	HO4	109.5°	115.7°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	O1	O5	118.0°	122.6°
C2	C1	O1	H1	120.7°	119.9°
C2	C1	O5	H1	120.7°	122.3°
C1	C2	C3	O2	121.3°	119.4°
C1	C2	C3	H2	119.5°	123.1°
C1	C2	O2	H2	119.6°	119.5°
C1	C2	C3	C4	53.1°	50.6°
C1	C2	C3	O3	174.1°	172.6°
C1	C2	C3	H3	66.2°	70.9°
C2	C1	O5	C5	62.6°	60.3°
C2	C1	O1	HO1	180.0°	162.3°
C1	C2	O2	HO2	180.0°	32.0°
O1	C1	O5	H1	121.9°	115.7°
O1	C1	C2	C3	174.0°	175.3°
O1	C1	C2	O2	63.6°	64.8°
O1	C1	C2	H2	55.6°	52.3°
O1	C1	O5	C5	180.0°	177.7°
O5	C1	C2	C3	57.3°	53.4°
O5	C1	C2	O2	179.7°	173.3°
O5	C1	C2	H2	61.1°	69.6°
C1	O5	C5	C4	62.4°	62.3°
C1	O5	C5	C6	174.8°	174.5°
C1	O5	C5	H5	55.1°	57.9°
O5	C1	O1	HO1	62.0°	75.1°
H1	C1	C2	C3	64.0°	67.8°
H1	C1	C2	O2	58.3°	52.1°
H1	C1	C2	H2	177.5°	169.2°
H1	C1	O5	C5	58.1°	62.0°
H1	C1	O1	HO1	59.3°	42.5°
C3	C2	O2	H2	118.4°	119.7°
C2	C3	C4	O3	120.9°	121.3°
C2	C3	C4	H3	119.3°	121.1°
C2	C3	O3	H3	119.3°	118.1°
C2	C3	C4	C5	52.2°	52.5°
C2	C3	C4	O4	67.7°	67.8°
C2	C3	C4	H4	172.3°	175.3°
C3	C2	O2	HO2	57.9°	152.8°
C2	C3	O3	HO3	179.9°	27.3°
O2	C2	C3	C4	174.4°	170.0°
O2	C2	C3	O3	64.6°	68.0°
O2	C2	C3	H3	55.1°	48.5°
H2	C2	C3	C4	66.4°	72.5°
H2	C2	C3	O3	54.6°	49.5°
H2	C2	C3	H3	174.3°	166.0°
H2	C2	O2	HO2	60.5°	87.5°
C4	C3	O3	H3	119.3°	119.5°
C3	C4	C5	O4	121.0°	119.4°
C3	C4	C5	H4	118.9°	121.9°
C3	C4	O4	H4	118.9°	118.6°
C3	C4	C5	C6	175.3°	177.0°
C3	C4	C5	O5	56.0°	57.1°
C3	C4	C5	H5	65.2°	62.3°
C4	C3	O3	HO3	58.7°	149.7°
C3	C4	O4	S	124.4°	60.0°
O3	C3	C4	C5	173.1°	173.8°
O3	C3	C4	O4	53.2°	53.5°
O3	C3	C4	H4	66.8°	63.4°
H3	C3	C4	C5	67.1°	68.6°
H3	C3	C4	O4	172.9°	171.1°
H3	C3	C4	H4	53.0°	54.2°
H3	C3	O3	HO3	60.6°	90.8°
C5	C4	O4	H4	120.2°	121.2°
C4	C5	C6	O5	121.3°	121.3°
C4	C5	C6	H5	117.5°	121.7°
C4	C5	O5	H5	117.5°	120.1°
C4	C5	C6	O6	176.1°	179.5°
C4	C5	C6	H61	58.7°	60.0°
C4	C5	C6	H62	50.8°	60.9°
C5	C4	O4	S	114.7°	179.9°
O4	C4	C5	C6	54.3°	57.6°
O4	C4	C5	O5	65.1°	62.2°
O4	C4	C5	H5	173.8°	178.4°
C4	O4	S	O7	158.6°	60.0°
C4	O4	S	O8	81.4°	71.6°
C4	O4	S	O9	38.6°	173.6°
H4	C4	C5	C6	65.7°	61.1°
H4	C4	C5	O5	174.9°	179.1°
H4	C4	C5	H5	53.8°	59.7°
H4	C4	O4	S	5.5°	58.7°
C6	C5	O5	H5	119.7°	116.7°
C5	C6	O6	H61	125.3°	120.0°
C5	C6	O6	H62	125.2°	120.1°
C5	C6	H61	H62	117.5°	121.1°
C5	C6	O6	HO6	180.0°	7.8°
O5	C5	C6	O6	54.8°	58.2°
O5	C5	C6	H61	179.9°	61.3°
O5	C5	C6	H62	70.5°	177.8°
H5	C5	C6	O6	66.4°	58.8°
H5	C5	C6	H61	58.8°	178.3°
H5	C5	C6	H62	168.3°	60.8°
O6	C6	H61	H62	117.5°	119.7°
H61	C6	O6	HO6	54.8°	112.2°
H62	C6	O6	HO6	54.7°	127.9°
O4	S	O7	O8	120.0°	125.2°
O4	S	O7	O9	120.1°	110.9°
O4	S	O8	O9	120.1°	112.0°
O4	S	O9	HO4	54.1°	52.6°
O7	S	O8	O9	119.9°	123.6°
O7	S	O9	HO4	66.0°	166.0°
O8	S	O9	HO4	174.1°	63.0°

Definition date:	1999-07-08
Last modified:	2020-07-17
Release status:	REL
Processing site:	RCSB
Replaces:	GSA
Derived from:	1CAR