16G

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.53Å	1.52Å
C1	O1	sing	1.43Å	1.46Å
C1	O5	sing	1.43Å	1.43Å
C1	H1	sing	1.09Å	1.10Å
C2	C3	sing	1.53Å	1.54Å
C2	N2	sing	1.46Å	1.42Å
C2	H2	sing	1.09Å	1.10Å
C3	C4	sing	1.53Å	1.56Å
C3	O3	sing	1.43Å	1.44Å
C3	H3	sing	1.09Å	1.10Å
C4	C5	sing	1.53Å	1.42Å
C4	O4	sing	1.43Å	1.43Å
C4	H4	sing	1.09Å	1.10Å
C5	C6	sing	1.53Å	1.45Å
C5	O5	sing	1.43Å	1.48Å
C5	H5	sing	1.09Å	1.10Å
C6	O6	sing	1.43Å	1.40Å
C6	H61	sing	1.09Å	1.10Å
C6	H62	sing	1.09Å	1.10Å
C7	C8	sing	1.51Å	1.46Å
C7	N2	sing	1.35Å	1.38Å
C7	O7	doub	1.21Å	1.18Å
C8	H81	sing	1.09Å	1.10Å
C8	H82	sing	1.09Å	1.10Å
C8	H83	sing	1.09Å	1.10Å
N2	HN2	sing	0.97Å	1.00Å
O1	HO1	sing	0.97Å	0.95Å
O3	HO3	sing	0.97Å	0.95Å
O4	HO4	sing	0.97Å	0.95Å
O6	P	sing	1.61Å	1.63Å
P	O1P	doub	1.48Å	1.51Å
P	O2P	sing	1.61Å	1.47Å
P	O3P	sing	1.61Å	1.51Å
O2P	HOP2	sing	0.97Å	0.95Å
O3P	HOP3	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	O1	108.5°	109.5°
C2	C1	O5	107.4°	109.4°
C2	C1	H1	111.9°	109.5°
C1	C2	C3	109.6°	109.2°
C1	C2	N2	109.0°	109.5°
C1	C2	H2	111.0°	109.5°
O1	C1	O5	110.6°	109.4°
O1	C1	H1	108.8°	109.5°
C1	O1	HO1	109.5°	114.0°
O5	C1	H1	109.8°	109.5°
C1	O5	C5	120.9°	114.1°
C3	C2	N2	113.1°	109.6°
C3	C2	H2	106.7°	109.5°
C2	C3	C4	108.4°	109.1°
C2	C3	O3	109.2°	109.5°
C2	C3	H3	110.7°	109.5°
N2	C2	H2	107.4°	109.6°
C2	N2	C7	116.6°	120.1°
C2	N2	HN2	121.7°	120.0°
C4	C3	O3	110.4°	109.6°
C4	C3	H3	109.5°	109.6°
C3	C4	C5	110.0°	109.2°
C3	C4	O4	114.9°	109.5°
C3	C4	H4	104.6°	109.5°
O3	C3	H3	108.7°	109.6°
C3	O3	HO3	109.5°	114.0°
C5	C4	O4	107.1°	109.5°
C5	C4	H4	112.7°	109.5°
C4	C5	C6	116.8°	109.4°
C4	C5	O5	111.6°	109.4°
C4	C5	H5	101.4°	109.5°
O4	C4	H4	107.6°	109.6°
C4	O4	HO4	109.5°	113.9°
C6	C5	O5	105.0°	109.5°
C6	C5	H5	108.4°	109.4°
C5	C6	O6	106.1°	109.4°
C5	C6	H61	110.6°	109.5°
C5	C6	H62	111.3°	109.5°
O5	C5	H5	113.9°	109.5°
O6	C6	H61	110.6°	109.5°
O6	C6	H62	111.3°	109.4°
C6	O6	P	121.3°	123.0°
H61	C6	H62	106.9°	109.5°
C8	C7	N2	116.4°	120.0°
C8	C7	O7	122.5°	120.0°
C7	C8	H81	109.5°	109.5°
C7	C8	H82	109.4°	109.5°
C7	C8	H83	109.5°	109.4°
N2	C7	O7	121.1°	120.0°
C7	N2	HN2	121.7°	119.9°
H81	C8	H82	109.5°	109.5°
H81	C8	H83	109.4°	109.5°
H82	C8	H83	109.5°	109.5°
O6	P	O1P	105.4°	109.5°
O6	P	O2P	99.1°	109.5°
O6	P	O3P	112.7°	109.4°
O1P	P	O2P	120.5°	109.5°
O1P	P	O3P	106.9°	109.5°
O2P	P	O3P	111.9°	109.5°
P	O2P	HOP2	109.5°	114.0°
P	O3P	HOP3	109.5°	114.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	O1	O5	117.5°	119.9°
C2	C1	O1	H1	121.9°	120.1°
C2	C1	O5	H1	121.8°	120.0°
C1	C2	C3	N2	121.9°	119.9°
C1	C2	C3	H2	120.3°	119.9°
C1	C2	N2	H2	120.3°	120.2°
C1	C2	C3	C4	61.3°	56.9°
C1	C2	C3	O3	178.5°	176.8°
C1	C2	C3	H3	58.9°	62.9°
C2	C1	O5	C5	50.5°	61.1°
C1	C2	N2	C7	124.3°	85.0°
C1	C2	N2	HN2	55.7°	95.0°
C2	C1	O1	HO1	166.2°	180.0°
O1	C1	O5	H1	120.0°	120.0°
O1	C1	C2	C3	64.8°	62.4°
O1	C1	C2	N2	59.5°	57.6°
O1	C1	C2	H2	177.6°	177.8°
O1	C1	O5	C5	67.7°	58.8°
O5	C1	C2	C3	54.7°	57.5°
O5	C1	C2	N2	179.0°	177.5°
O5	C1	C2	H2	62.9°	62.3°
C1	O5	C5	C4	50.8°	61.2°
C1	O5	C5	C6	178.2°	178.9°
C1	O5	C5	H5	63.3°	58.9°
O5	C1	O1	HO1	48.7°	60.1°
H1	C1	C2	C3	175.3°	177.6°
H1	C1	C2	N2	60.4°	62.5°
H1	C1	C2	H2	57.6°	57.7°
H1	C1	O5	C5	172.3°	178.8°
H1	C1	O1	HO1	72.0°	59.9°
C3	C2	N2	H2	117.5°	120.1°
C2	C3	C4	O3	119.5°	119.9°
C2	C3	C4	H3	120.8°	119.9°
C2	C3	O3	H3	120.9°	120.2°
C2	C3	C4	C5	59.8°	57.0°
C2	C3	C4	O4	179.2°	176.9°
C2	C3	C4	H4	61.5°	62.9°
C3	C2	N2	C7	113.5°	155.3°
C3	C2	N2	HN2	66.5°	24.7°
C2	C3	O3	HO3	108.1°	180.0°
N2	C2	C3	C4	176.8°	176.9°
N2	C2	C3	O3	56.6°	63.2°
N2	C2	C3	H3	63.0°	57.0°
C2	N2	C7	C8	179.9°	180.0°
C2	N2	C7	HN2	180.0°	180.0°
C2	N2	C7	O7	0.0°	0.0°
H2	C2	C3	C4	59.0°	62.9°
H2	C2	C3	O3	61.3°	57.0°
H2	C2	C3	H3	179.1°	177.2°
H2	C2	N2	C7	4.0°	35.1°
H2	C2	N2	HN2	176.0°	144.8°
C4	C3	O3	H3	120.1°	120.2°
C3	C4	C5	O4	125.5°	119.9°
C3	C4	C5	H4	116.4°	119.9°
C3	C4	O4	H4	116.1°	120.2°
C3	C4	C5	C6	172.2°	177.6°
C3	C4	C5	O5	51.4°	57.6°
C3	C4	C5	H5	70.3°	62.4°
C4	C3	O3	HO3	132.9°	60.4°
C3	C4	O4	HO4	161.8°	180.0°
O3	C3	C4	C5	179.3°	176.8°
O3	C3	C4	O4	59.7°	63.2°
O3	C3	C4	H4	58.0°	57.0°
H3	C3	C4	C5	61.0°	62.9°
H3	C3	C4	O4	59.9°	57.0°
H3	C3	C4	H4	177.7°	177.2°
H3	C3	O3	HO3	12.8°	59.8°
C5	C4	O4	H4	121.4°	120.2°
C4	C5	C6	O5	124.3°	119.9°
C4	C5	C6	H5	113.6°	120.0°
C4	C5	O5	H5	114.1°	120.0°
C4	C5	C6	O6	158.9°	175.0°
C4	C5	C6	H61	38.9°	54.9°
C4	C5	C6	H62	79.8°	65.1°
C5	C4	O4	HO4	75.7°	60.4°
O4	C4	C5	C6	62.3°	62.5°
O4	C4	C5	O5	176.8°	177.5°
O4	C4	C5	H5	55.2°	57.5°
H4	C4	C5	C6	55.8°	57.7°
H4	C4	C5	O5	65.0°	62.3°
H4	C4	C5	H5	173.4°	177.7°
H4	C4	O4	HO4	45.8°	59.8°
C6	C5	O5	H5	118.5°	120.0°
C5	C6	O6	H61	120.0°	120.1°
C5	C6	O6	H62	121.3°	120.0°
C5	C6	H61	H62	121.3°	120.0°
C5	C6	O6	P	126.0°	180.0°
O5	C5	C6	O6	76.9°	65.0°
O5	C5	C6	H61	163.1°	174.9°
O5	C5	C6	H62	44.4°	54.9°
H5	C5	C6	O6	45.2°	55.0°
H5	C5	C6	H61	74.8°	65.1°
H5	C5	C6	H62	166.5°	174.9°
O6	C6	H61	H62	121.4°	119.9°
C6	O6	P	O1P	50.3°	55.0°
C6	O6	P	O2P	175.6°	175.0°
C6	O6	P	O3P	65.9°	64.9°
H61	C6	O6	P	6.1°	59.9°
H62	C6	O6	P	112.7°	60.0°
C8	C7	N2	O7	179.9°	180.0°
C7	C8	H81	H82	120.0°	120.0°
C7	C8	H81	H83	120.0°	120.0°
C7	C8	H82	H83	120.0°	120.0°
C8	C7	N2	HN2	0.1°	0.1°
N2	C7	C8	H81	55.2°	90.0°
N2	C7	C8	H82	64.8°	150.0°
N2	C7	C8	H83	175.2°	30.0°
O7	C7	C8	H81	124.9°	90.0°
O7	C7	C8	H82	115.1°	30.0°
O7	C7	C8	H83	4.9°	150.0°
O7	C7	N2	HN2	180.0°	180.0°
H81	C8	H82	H83	120.0°	120.0°
O6	P	O1P	O2P	110.7°	120.0°
O6	P	O1P	O3P	120.1°	120.0°
O6	P	O2P	O3P	119.0°	120.0°
O6	P	O2P	HOP2	100.0°	180.0°
O6	P	O3P	HOP3	38.6°	60.1°
O1P	P	O2P	O3P	127.0°	120.0°
O1P	P	O2P	HOP2	146.0°	60.0°
O1P	P	O3P	HOP3	153.9°	180.0°
O2P	P	O3P	HOP3	72.1°	59.9°
O3P	P	O2P	HOP2	19.1°	60.0°

Definition date:	2000-09-13
Last modified:	2020-07-17
Release status:	REL
Processing site:	RCSB
Derived from:	1I1D