BGN

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	1.38Å
C1	O5	sing	1.43Å	1.40Å
C1	H1	sing	1.09Å	1.12Å
C2	C3	sing	1.53Å	1.51Å
C2	N2	sing	1.46Å	1.49Å
C2	H2	sing	1.09Å	1.11Å
C3	C4	sing	1.53Å	1.52Å
C3	O3	sing	1.43Å	1.44Å
C3	H3	sing	1.09Å	1.11Å
C4	C5	sing	1.53Å	1.58Å
C4	O4	sing	1.43Å	1.43Å
C4	H4	sing	1.09Å	1.12Å
C5	C6	sing	1.53Å	1.52Å
C5	O5	sing	1.43Å	1.46Å
C5	H5	sing	1.09Å	1.11Å
C6	O6	sing	1.43Å	1.44Å
C6	H61	sing	1.09Å	1.12Å
C6	H62	sing	1.09Å	1.12Å
C7	C8	sing	1.51Å	1.53Å
C7	N2	sing	1.35Å	1.34Å
C7	O7	doub	1.21Å	1.22Å
C8	C9	sing	1.53Å	1.54Å
C8	H81	sing	1.09Å	1.11Å
C8	H82	sing	1.09Å	1.12Å
C9	C10	sing	1.53Å	1.54Å
C9	H91	sing	1.09Å	1.11Å
C9	H92	sing	1.09Å	1.11Å
C10	H101	sing	1.09Å	1.11Å
C10	H102	sing	1.09Å	1.11Å
C10	H103	sing	1.09Å	1.12Å
N2	HN21	sing	0.97Å	1.02Å
O1	HO1	sing	0.97Å	0.95Å
O3	HO3	sing	0.97Å	0.95Å
O4	HO4	sing	0.97Å	0.95Å
O6	HO6	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	O1	107.6°	109.5°
C2	C1	O5	110.8°	109.9°
C2	C1	H1	109.7°	109.4°
C1	C2	C3	108.7°	109.1°
C1	C2	N2	110.0°	109.6°
C1	C2	H2	109.2°	109.5°
O1	C1	O5	109.0°	109.3°
O1	C1	H1	111.5°	109.4°
C1	O1	HO1	107.5°	106.9°
O5	C1	H1	108.2°	109.4°
C1	O5	C5	115.0°	107.7°
C3	C2	N2	108.0°	109.6°
C3	C2	H2	111.1°	109.5°
C2	C3	C4	111.7°	108.7°
C2	C3	O3	107.2°	109.9°
C2	C3	H3	110.3°	109.5°
N2	C2	H2	109.9°	109.5°
C2	N2	C7	123.7°	120.1°
C2	N2	HN21	123.6°	120.0°
C4	C3	O3	111.8°	109.7°
C4	C3	H3	105.5°	109.6°
C3	C4	C5	110.7°	109.1°
C3	C4	O4	109.7°	109.7°
C3	C4	H4	108.2°	109.4°
O3	C3	H3	110.3°	109.6°
C3	O3	HO3	107.2°	106.8°
C5	C4	O4	108.2°	109.6°
C5	C4	H4	109.6°	109.5°
C4	C5	C6	114.2°	109.4°
C4	C5	O5	109.0°	109.8°
C4	C5	H5	105.7°	109.4°
O4	C4	H4	110.5°	109.5°
C4	O4	HO4	109.7°	106.9°
C6	C5	O5	106.6°	109.5°
C6	C5	H5	108.0°	109.4°
C5	C6	O6	111.6°	109.5°
C5	C6	H61	111.4°	109.5°
C5	C6	H62	111.4°	109.4°
O5	C5	H5	113.4°	109.3°
O6	C6	H61	111.4°	109.5°
O6	C6	H62	111.4°	109.5°
C6	O6	HO6	111.6°	106.8°
H61	C6	H62	98.9°	109.4°
C8	C7	N2	112.2°	120.1°
C8	C7	O7	122.8°	120.0°
C7	C8	C9	109.3°	109.6°
C7	C8	H81	112.2°	109.5°
C7	C8	H82	112.2°	109.5°
N2	C7	O7	125.0°	119.9°
C7	N2	HN21	112.7°	119.9°
C9	C8	H81	112.3°	109.5°
C9	C8	H82	112.3°	109.4°
C8	C9	C10	107.7°	109.6°
C8	C9	H91	112.8°	109.5°
C8	C9	H92	112.8°	109.5°
H81	C8	H82	98.2°	109.4°
C10	C9	H91	112.9°	109.5°
C10	C9	H92	112.9°	109.4°
C9	C10	H101	107.7°	109.6°
C9	C10	H102	112.9°	109.5°
C9	C10	H103	112.8°	109.5°
H91	C9	H92	97.7°	109.4°
H101	C10	H102	112.9°	109.4°
H101	C10	H103	112.8°	109.4°
H102	C10	H103	97.6°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	O1	O5	120.3°	120.4°
C2	C1	O1	H1	120.3°	119.8°
C2	C1	O5	H1	120.3°	120.1°
C1	C2	C3	N2	119.3°	120.0°
C1	C2	C3	H2	120.1°	119.9°
C1	C2	N2	H2	120.2°	120.2°
C1	C2	C3	C4	55.7°	53.5°
C1	C2	C3	O3	178.5°	173.5°
C1	C2	C3	H3	61.4°	66.1°
C2	C1	O5	C5	62.0°	67.5°
C1	C2	N2	C7	106.8°	90.1°
C1	C2	N2	HN21	73.2°	89.8°
C2	C1	O1	HO1	180.0°	179.9°
O1	C1	O5	H1	121.4°	119.7°
O1	C1	C2	C3	178.3°	178.8°
O1	C1	C2	N2	63.7°	58.8°
O1	C1	C2	H2	56.9°	61.3°
O1	C1	O5	C5	179.7°	172.4°
O5	C1	C2	C3	59.1°	61.2°
O5	C1	C2	N2	177.2°	178.9°
O5	C1	C2	H2	62.2°	58.7°
C1	O5	C5	C4	56.5°	67.5°
C1	O5	C5	C6	179.7°	172.4°
C1	O5	C5	H5	60.9°	52.5°
O5	C1	O1	HO1	59.7°	59.7°
H1	C1	C2	C3	60.3°	59.0°
H1	C1	C2	N2	57.7°	61.0°
H1	C1	C2	H2	178.4°	178.9°
H1	C1	O5	C5	58.3°	52.6°
H1	C1	O1	HO1	59.7°	60.1°
C3	C2	N2	H2	121.3°	120.1°
C2	C3	C4	O3	120.2°	120.2°
C2	C3	C4	H3	119.9°	119.6°
C2	C3	O3	H3	120.1°	120.3°
C2	C3	C4	C5	52.5°	53.5°
C2	C3	C4	O4	171.9°	173.5°
C2	C3	C4	H4	67.5°	66.3°
C3	C2	N2	C7	134.7°	150.2°
C3	C2	N2	HN21	45.3°	29.9°
C2	C3	O3	HO3	179.9°	179.3°
N2	C2	C3	C4	175.0°	173.5°
N2	C2	C3	O3	62.2°	66.5°
N2	C2	C3	H3	57.9°	53.9°
C2	N2	C7	C8	179.7°	180.0°
C2	N2	C7	HN21	180.0°	179.9°
C2	N2	C7	O7	0.0°	0.1°
H2	C2	C3	C4	64.5°	66.4°
H2	C2	C3	O3	58.4°	53.6°
H2	C2	C3	H3	178.5°	174.0°
H2	C2	N2	C7	13.4°	30.1°
H2	C2	N2	HN21	166.6°	150.0°
C4	C3	O3	H3	117.1°	120.3°
C3	C4	C5	O4	120.2°	120.1°
C3	C4	C5	H4	119.2°	119.7°
C3	C4	O4	H4	119.2°	120.1°
C3	C4	C5	C6	169.2°	178.7°
C3	C4	C5	O5	50.1°	61.1°
C3	C4	C5	H5	72.2°	58.9°
C4	C3	O3	HO3	57.2°	59.9°
C3	C4	O4	HO4	180.0°	179.7°
O3	C3	C4	C5	172.7°	173.6°
O3	C3	C4	O4	67.9°	66.3°
O3	C3	C4	H4	52.7°	53.8°
H3	C3	C4	C5	67.4°	66.1°
H3	C3	C4	O4	52.0°	53.9°
H3	C3	C4	H4	172.6°	174.1°
H3	C3	O3	HO3	59.9°	60.3°
C5	C4	O4	H4	120.0°	120.2°
C4	C5	C6	O5	120.4°	120.4°
C4	C5	C6	H5	117.3°	119.8°
C4	C5	O5	H5	117.5°	120.0°
C4	C5	C6	O6	60.6°	179.7°
C4	C5	C6	H61	174.1°	59.6°
C4	C5	C6	H62	64.7°	60.3°
C5	C4	O4	HO4	59.2°	59.9°
O4	C4	C5	C6	70.5°	58.6°
O4	C4	C5	O5	170.4°	178.8°
O4	C4	C5	H5	48.1°	61.2°
H4	C4	C5	C6	50.0°	61.5°
H4	C4	C5	O5	69.1°	58.7°
H4	C4	C5	H5	168.7°	178.7°
H4	C4	O4	HO4	60.8°	60.3°
C6	C5	O5	H5	118.8°	119.8°
C5	C6	O6	H61	125.3°	120.1°
C5	C6	O6	H62	125.3°	120.0°
C5	C6	H61	H62	117.3°	119.9°
C5	C6	O6	HO6	180.0°	180.0°
O5	C5	C6	O6	59.8°	59.9°
O5	C5	C6	H61	65.4°	180.0°
O5	C5	C6	H62	174.9°	60.1°
H5	C5	C6	O6	177.9°	59.9°
H5	C5	C6	H61	56.8°	60.2°
H5	C5	C6	H62	52.6°	179.9°
O6	C6	H61	H62	117.3°	120.0°
H61	C6	O6	HO6	54.7°	59.9°
H62	C6	O6	HO6	54.7°	60.0°
C8	C7	N2	O7	179.8°	179.9°
C7	C8	C9	H81	125.3°	120.1°
C7	C8	C9	H82	125.2°	120.0°
C7	C8	H81	H82	118.1°	120.0°
C7	C8	C9	C10	80.6°	180.0°
C7	C8	C9	H91	44.6°	59.9°
C7	C8	C9	H92	154.1°	60.0°
C8	C7	N2	HN21	0.3°	0.0°
N2	C7	C8	C9	135.7°	180.0°
N2	C7	C8	H81	99.0°	60.0°
N2	C7	C8	H82	10.4°	59.9°
O7	C7	C8	C9	44.1°	0.1°
O7	C7	C8	H81	81.2°	120.1°
O7	C7	C8	H82	169.4°	119.9°
O7	C7	N2	HN21	179.9°	179.9°
C9	C8	H81	H82	118.2°	119.9°
C8	C9	C10	H91	125.2°	120.1°
C8	C9	C10	H92	125.2°	120.0°
C8	C9	H91	H92	118.8°	120.0°
C8	C9	C10	H101	180.0°	180.0°
C8	C9	C10	H102	54.7°	60.0°
C8	C9	C10	H103	54.8°	60.0°
H81	C8	C9	C10	154.1°	59.9°
H81	C8	C9	H91	80.6°	180.0°
H81	C8	C9	H92	28.9°	60.1°
H82	C8	C9	C10	44.6°	60.0°
H82	C8	C9	H91	169.9°	60.1°
H82	C8	C9	H92	80.6°	180.0°
C10	C9	H91	H92	118.8°	119.9°
C9	C10	H101	H102	125.3°	120.0°
C9	C10	H101	H103	125.2°	120.1°
C9	C10	H102	H103	118.8°	120.0°
H91	C9	C10	H101	54.8°	59.9°
H91	C9	C10	H102	179.9°	60.1°
H91	C9	C10	H103	70.5°	179.9°
H92	C9	C10	H101	54.8°	60.0°
H92	C9	C10	H102	70.5°	180.0°
H92	C9	C10	H103	180.0°	60.0°
H101	C10	H102	H103	118.8°	119.9°

Definition date:	2001-07-31
Last modified:	2020-07-17
Release status:	REL
Processing site:	RCSB