GL9

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.53Å	1.55Å
C1	O5	sing	1.42Å	1.44Å
C1	N2	sing	1.47Å	1.41Å
C1	C7	sing	1.51Å	1.52Å
C2	O2	sing	1.43Å	1.40Å
C2	C3	sing	1.53Å	1.59Å
C2	H2	sing	1.09Å	1.11Å
O2	HO2	sing	0.97Å	0.95Å
C3	O3	sing	1.43Å	1.40Å
C3	C4	sing	1.53Å	1.51Å
C3	H3	sing	1.09Å	1.12Å
O3	HO3	sing	0.97Å	0.95Å
C4	O4	sing	1.43Å	1.38Å
C4	C5	sing	1.53Å	1.52Å
C4	H4	sing	1.09Å	1.11Å
O4	HO4	sing	0.97Å	0.95Å
C5	C6	sing	1.53Å	1.48Å
C5	O5	sing	1.43Å	1.44Å
C5	H5	sing	1.09Å	1.12Å
C6	O6	sing	1.43Å	1.40Å
C6	H61	sing	1.09Å	1.11Å
C6	H62	sing	1.09Å	1.12Å
O6	HO6	sing	0.97Å	0.95Å
N2	C8	sing	1.35Å	1.33Å
N2	HN2	sing	0.97Å	1.02Å
C8	O8	doub	1.22Å	1.23Å
C8	N1	sing	1.34Å	1.35Å
N1	C7	sing	1.35Å	1.35Å
N1	N3	sing	1.40Å	1.22Å
C7	O7	doub	1.21Å	1.22Å
N3	C9	sing	1.35Å	1.34Å
N3	HN3	sing	0.97Å	1.02Å
C9	O9	doub	1.21Å	1.23Å
C9	C10	sing	1.51Å	1.51Å
C10	H101	sing	1.09Å	1.11Å
C10	H102	sing	1.09Å	1.12Å
C10	H103	sing	1.09Å	1.11Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	O5	111.9°	111.1°
C2	C1	N2	106.3°	110.3°
C2	C1	C7	117.7°	110.4°
C1	C2	O2	108.3°	109.6°
C1	C2	C3	109.0°	109.1°
C1	C2	H2	111.3°	109.5°
O5	C1	N2	109.4°	110.5°
O5	C1	C7	111.1°	110.3°
C1	O5	C5	114.2°	107.9°
N2	C1	C7	99.4°	104.0°
C1	N2	C8	107.6°	106.4°
C1	N2	HN2	112.9°	126.7°
C1	C7	N1	113.7°	105.6°
C1	C7	O7	124.0°	127.3°
O2	C2	C3	111.6°	109.5°
O2	C2	H2	108.7°	109.5°
C2	O2	HO2	108.2°	106.9°
C3	C2	H2	108.0°	109.5°
C2	C3	O3	114.4°	109.8°
C2	C3	C4	108.2°	108.6°
C2	C3	H3	106.5°	109.6°
O3	C3	C4	107.8°	109.6°
O3	C3	H3	106.9°	109.7°
C3	O3	HO3	114.4°	106.8°
C4	C3	H3	113.2°	109.6°
C3	C4	O4	107.2°	109.6°
C3	C4	C5	108.8°	109.0°
C3	C4	H4	111.7°	109.6°
O4	C4	C5	110.5°	109.5°
O4	C4	H4	110.1°	109.5°
C4	O4	HO4	107.2°	106.8°
C5	C4	H4	108.5°	109.5°
C4	C5	C6	108.8°	109.3°
C4	C5	O5	107.9°	109.8°
C4	C5	H5	110.9°	109.4°
C6	C5	O5	109.5°	109.4°
C6	C5	H5	109.4°	109.4°
C5	C6	O6	109.9°	109.4°
C5	C6	H61	112.1°	109.5°
C5	C6	H62	112.1°	109.5°
O5	C5	H5	110.3°	109.4°
O6	C6	H61	112.1°	109.4°
O6	C6	H62	112.0°	109.5°
C6	O6	HO6	109.9°	106.8°
H61	C6	H62	98.3°	109.5°
C8	N2	HN2	112.9°	126.8°
N2	C8	O8	118.9°	123.8°
N2	C8	N1	118.1°	112.5°
O8	C8	N1	123.0°	123.8°
C8	N1	C7	100.8°	111.5°
C8	N1	N3	127.6°	124.2°
C7	N1	N3	131.7°	124.3°
N1	C7	O7	122.3°	127.1°
N1	N3	C9	133.8°	120.0°
N1	N3	HN3	106.9°	120.0°
C9	N3	HN3	119.3°	120.0°
N3	C9	O9	121.9°	120.0°
N3	C9	C10	120.7°	120.1°
O9	C9	C10	117.3°	119.9°
C9	C10	H101	120.7°	109.6°
C9	C10	H102	108.2°	109.4°
C9	C10	H103	108.2°	109.4°
H101	C10	H102	108.2°	109.5°
H101	C10	H103	108.2°	109.5°
H102	C10	H103	101.7°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	O5	N2	117.5°	122.7°
C2	C1	O5	C7	133.7°	122.8°
C2	C1	N2	C7	122.6°	118.4°
C1	C2	O2	C3	120.0°	119.7°
C1	C2	O2	H2	121.1°	120.2°
C1	C2	C3	H2	121.1°	119.9°
C1	C2	O2	HO2	180.0°	179.7°
C1	C2	C3	O3	174.2°	172.8°
C1	C2	C3	C4	54.1°	53.0°
C1	C2	C3	H3	67.9°	66.7°
C2	C1	O5	C5	56.8°	66.2°
C2	C1	N2	C8	116.3°	118.2°
C2	C1	N2	HN2	9.0°	61.8°
C2	C1	C7	N1	108.6°	117.9°
C2	C1	C7	O7	70.3°	61.7°
O5	C1	N2	C7	116.4°	118.4°
O5	C1	C2	O2	172.3°	179.8°
O5	C1	C2	C3	50.7°	59.9°
O5	C1	C2	H2	68.3°	60.0°
C1	O5	C5	C4	62.3°	66.7°
C1	O5	C5	C6	179.5°	173.3°
C1	O5	C5	H5	59.0°	53.4°
O5	C1	N2	C8	122.7°	118.6°
O5	C1	N2	HN2	112.0°	61.4°
O5	C1	C7	N1	120.6°	118.9°
O5	C1	C7	O7	60.5°	61.5°
N2	C1	C2	O2	68.4°	57.2°
N2	C1	C2	C3	170.1°	177.2°
N2	C1	C2	H2	51.1°	62.9°
N2	C1	O5	C5	174.3°	171.1°
C1	N2	C8	HN2	125.2°	180.0°
C1	N2	C8	O8	171.6°	180.0°
C1	N2	C8	N1	6.2°	0.0°
N2	C1	C7	N1	5.4°	0.4°
N2	C1	C7	O7	175.7°	180.0°
C7	C1	C2	O2	41.8°	57.1°
C7	C1	C2	C3	79.7°	62.8°
C7	C1	C2	H2	161.3°	177.3°
C7	C1	O5	C5	77.0°	56.6°
C7	C1	N2	C8	6.3°	0.2°
C7	C1	N2	HN2	131.6°	179.8°
C1	C7	N1	C8	2.2°	0.4°
C1	C7	N1	O7	178.9°	179.6°
C1	C7	N1	N3	177.8°	179.9°
O2	C2	C3	H2	119.4°	120.1°
O2	C2	C3	O3	66.3°	67.2°
O2	C2	C3	C4	173.6°	173.0°
O2	C2	C3	H3	51.6°	53.3°
C3	C2	O2	HO2	60.0°	60.0°
C2	C3	O3	C4	120.4°	119.2°
C2	C3	O3	H3	117.6°	120.5°
C2	C3	C4	H3	117.8°	119.7°
C2	C3	O3	HO3	180.0°	179.2°
C2	C3	C4	O4	179.0°	174.1°
C2	C3	C4	C5	61.5°	54.2°
C2	C3	C4	H4	58.3°	65.7°
H2	C2	O2	HO2	58.9°	60.2°
H2	C2	C3	O3	53.2°	52.9°
H2	C2	C3	C4	67.0°	66.9°
H2	C2	C3	H3	171.0°	173.4°
O3	C3	C4	H3	118.0°	120.4°
O3	C3	C4	O4	54.8°	66.0°
O3	C3	C4	C5	174.3°	174.1°
O3	C3	C4	H4	65.9°	54.2°
C4	C3	O3	HO3	59.6°	60.1°
C3	C4	O4	C5	118.4°	119.6°
C3	C4	O4	H4	121.7°	120.3°
C3	C4	C5	H4	121.8°	119.9°
C3	C4	O4	HO4	180.0°	179.6°
C3	C4	C5	C6	176.7°	178.2°
C3	C4	C5	O5	64.6°	61.7°
C3	C4	C5	H5	56.3°	58.4°
H3	C3	O3	HO3	62.4°	60.3°
H3	C3	C4	O4	63.2°	54.4°
H3	C3	C4	C5	56.3°	65.5°
H3	C3	C4	H4	176.1°	174.6°
O4	C4	C5	H4	120.8°	120.1°
O4	C4	C5	C6	59.3°	58.2°
O4	C4	C5	O5	177.9°	178.3°
O4	C4	C5	H5	61.1°	61.6°
C5	C4	O4	HO4	61.6°	60.0°
C4	C5	C6	O5	117.7°	120.3°
C4	C5	C6	H5	121.3°	119.8°
C4	C5	O5	H5	121.3°	120.1°
C4	C5	C6	O6	56.9°	179.7°
C4	C5	C6	H61	177.8°	59.7°
C4	C5	C6	H62	68.4°	60.3°
H4	C4	O4	HO4	58.3°	60.1°
H4	C4	C5	C6	61.5°	61.9°
H4	C4	C5	O5	57.2°	58.2°
H4	C4	C5	H5	178.1°	178.3°
C6	C5	O5	H5	120.5°	119.9°
C5	C6	O6	H61	125.3°	120.0°
C5	C6	O6	H62	125.3°	120.0°
C5	C6	H61	H62	118.0°	120.0°
C5	C6	O6	HO6	180.0°	180.0°
O5	C5	C6	O6	60.8°	60.0°
O5	C5	C6	H61	64.5°	180.0°
O5	C5	C6	H62	173.9°	60.0°
H5	C5	C6	O6	178.2°	59.8°
H5	C5	C6	H61	56.5°	60.1°
H5	C5	C6	H62	52.9°	179.9°
O6	C6	H61	H62	117.9°	120.1°
H61	C6	O6	HO6	54.7°	60.1°
H62	C6	O6	HO6	54.7°	60.0°
N2	C8	O8	N1	177.8°	180.0°
N2	C8	N1	C7	2.5°	0.3°
N2	C8	N1	N3	177.6°	179.9°
HN2	N2	C8	O8	46.4°	0.0°
HN2	N2	C8	N1	131.5°	179.9°
O8	C8	N1	C7	175.3°	179.7°
O8	C8	N1	N3	4.6°	0.1°
C8	N1	C7	N3	179.9°	179.6°
C8	N1	C7	O7	178.9°	180.0°
C8	N1	N3	C9	122.9°	90.0°
C8	N1	N3	HN3	57.2°	89.9°
C7	N1	N3	C9	57.2°	90.4°
C7	N1	N3	HN3	122.7°	89.7°
N3	N1	C7	O7	1.1°	0.3°
N1	N3	C9	HN3	179.9°	179.9°
N1	N3	C9	O9	144.7°	0.1°
N1	N3	C9	C10	37.1°	180.0°
N3	C9	O9	C10	178.3°	179.9°
N3	C9	C10	H101	180.0°	179.9°
N3	C9	C10	H102	54.7°	59.9°
N3	C9	C10	H103	54.7°	60.0°
HN3	N3	C9	O9	35.3°	180.0°
HN3	N3	C9	C10	142.9°	0.1°
O9	C9	C10	H101	1.7°	0.0°
O9	C9	C10	H102	127.0°	120.0°
O9	C9	C10	H103	123.6°	120.1°
C9	C10	H101	H102	125.2°	120.0°
C9	C10	H101	H103	125.3°	120.0°
C9	C10	H102	H103	113.8°	119.9°
H101	C10	H102	H103	113.8°	120.0°

Definition date:	2000-09-15
Last modified:	2020-07-17
Release status:	REL
Processing site:	EBI
Derived from:	1FU4