MMN

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C8	C7	sing	1.53Å	1.53Å
C8	H81	sing	1.09Å	1.11Å
C8	H82	sing	1.09Å	1.11Å
C8	H83	sing	1.09Å	1.11Å
C7	O7	sing	1.43Å	1.23Å
C7	N1	sing	1.47Å	1.33Å
C7	H7	sing	1.09Å	1.11Å
O7	HO7	sing	0.97Å	0.95Å
N1	C2	sing	1.47Å	1.47Å
N1	HN1	sing	1.01Å	1.02Å
C2	C1	sing	1.53Å	1.53Å
C2	C3	sing	1.53Å	1.53Å
C2	H2	sing	1.09Å	1.11Å
C1	O1	sing	1.43Å	1.43Å
C1	H11	sing	1.09Å	1.11Å
C1	H12	sing	1.09Å	1.12Å
O1	HO1	sing	0.97Å	0.95Å
C3	O3	sing	1.43Å	1.43Å
C3	C4	sing	1.53Å	1.53Å
C3	H3	sing	1.09Å	1.12Å
O3	HO3	sing	0.97Å	0.95Å
C4	O4	sing	1.43Å	1.43Å
C4	C5	sing	1.53Å	1.53Å
C4	H4	sing	1.09Å	1.12Å
O4	HO4	sing	0.97Å	0.95Å
C5	O5	sing	1.43Å	1.43Å
C5	C6	sing	1.53Å	1.53Å
C5	H5	sing	1.09Å	1.11Å
O5	HO5	sing	0.97Å	0.95Å
C6	O6	sing	1.43Å	1.43Å
C6	H61	sing	1.09Å	1.12Å
C6	H62	sing	1.09Å	1.12Å
O6	HO6	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C7	C8	H81	108.2°	109.4°
C7	C8	H82	120.7°	109.5°
C7	C8	H83	108.2°	109.5°
C8	C7	O7	120.7°	109.5°
C8	C7	N1	114.8°	109.5°
C8	C7	H7	145.2°	109.4°
H81	C8	H82	108.2°	109.5°
H81	C8	H83	101.7°	109.4°
H82	C8	H83	108.2°	109.5°
O7	C7	N1	124.5°	109.5°
O7	C7	H7	25.0°	109.4°
C7	O7	HO7	120.8°	106.8°
N1	C7	H7	99.8°	109.5°
C7	N1	C2	123.1°	106.7°
C7	N1	HN1	107.4°	106.7°
C2	N1	HN1	107.4°	106.7°
N1	C2	C1	110.2°	109.4°
N1	C2	C3	109.7°	109.5°
N1	C2	H2	109.4°	109.5°
C1	C2	C3	111.1°	109.5°
C1	C2	H2	107.9°	109.5°
C2	C1	O1	110.2°	109.5°
C2	C1	H11	111.9°	109.5°
C2	C1	H12	111.9°	109.5°
C3	C2	H2	108.4°	109.5°
C2	C3	O3	109.0°	109.5°
C2	C3	C4	111.0°	109.5°
C2	C3	H3	108.8°	109.5°
O1	C1	H11	111.9°	109.4°
O1	C1	H12	111.9°	109.5°
C1	O1	HO1	110.2°	106.8°
H11	C1	H12	98.5°	109.4°
O3	C3	C4	109.5°	109.4°
O3	C3	H3	110.3°	109.5°
C3	O3	HO3	109.0°	106.8°
C4	C3	H3	108.3°	109.5°
C3	C4	O4	109.1°	109.5°
C3	C4	C5	111.5°	109.5°
C3	C4	H4	108.3°	109.4°
O4	C4	C5	109.4°	109.5°
O4	C4	H4	110.5°	109.5°
C4	O4	HO4	109.1°	106.8°
C5	C4	H4	108.0°	109.4°
C4	C5	O5	109.9°	109.5°
C4	C5	C6	110.9°	109.5°
C4	C5	H5	108.1°	109.4°
O5	C5	C6	109.1°	109.5°
O5	C5	H5	110.0°	109.4°
C5	O5	HO5	109.9°	106.8°
C6	C5	H5	108.9°	109.5°
C5	C6	O6	109.6°	109.4°
C5	C6	H61	112.2°	109.5°
C5	C6	H62	112.2°	109.5°
O6	C6	H61	112.2°	109.5°
O6	C6	H62	112.1°	109.4°
C6	O6	HO6	109.6°	106.8°
H61	C6	H62	98.2°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C7	C8	H81	H82	132.4°	120.0°
C7	C8	H81	H83	113.8°	120.0°
C7	C8	H82	H83	125.3°	120.0°
C8	C7	O7	N1	179.6°	120.0°
C8	C7	O7	H7	170.1°	120.0°
C8	C7	N1	H7	176.0°	120.0°
C8	C7	O7	HO7	180.0°	60.0°
C8	C7	N1	C2	179.9°	140.0°
C8	C7	N1	HN1	54.9°	26.2°
H81	C8	H82	H83	109.4°	120.0°
H81	C8	C7	O7	54.7°	60.0°
H81	C8	C7	N1	124.9°	60.0°
H81	C8	C7	H7	62.1°	179.9°
H82	C8	C7	O7	180.0°	180.0°
H82	C8	C7	N1	0.4°	60.0°
H82	C8	C7	H7	172.6°	60.0°
H83	C8	C7	O7	54.7°	60.0°
H83	C8	C7	N1	125.7°	180.0°
H83	C8	C7	H7	47.4°	60.0°
O7	C7	N1	H7	4.4°	120.0°
O7	C7	N1	C2	0.5°	100.0°
O7	C7	N1	HN1	124.7°	146.3°
N1	C7	O7	HO7	0.4°	60.0°
C7	N1	C2	HN1	125.2°	113.7°
C7	N1	C2	C1	115.8°	85.1°
C7	N1	C2	C3	121.5°	155.0°
C7	N1	C2	H2	2.7°	34.9°
H7	C7	O7	HO7	9.9°	180.0°
H7	C7	N1	C2	3.9°	20.0°
H7	C7	N1	HN1	129.2°	93.8°
N1	C2	C1	C3	121.9°	119.9°
N1	C2	C1	H2	119.4°	120.0°
N1	C2	C3	H2	119.4°	120.1°
N1	C2	C1	O1	53.4°	64.1°
N1	C2	C1	H11	178.6°	55.9°
N1	C2	C1	H12	71.9°	175.8°
N1	C2	C3	O3	175.9°	174.8°
N1	C2	C3	C4	63.4°	65.3°
N1	C2	C3	H3	55.6°	54.8°
HN1	N1	C2	C1	9.4°	161.2°
HN1	N1	C2	C3	113.3°	41.3°
HN1	N1	C2	H2	127.9°	78.8°
C1	C2	C3	H2	118.5°	120.0°
C2	C1	O1	H11	125.2°	120.0°
C2	C1	O1	H12	125.3°	120.1°
C2	C1	H11	H12	117.9°	120.0°
C2	C1	O1	HO1	180.0°	180.0°
C1	C2	C3	O3	53.8°	54.8°
C1	C2	C3	C4	174.5°	174.8°
C1	C2	C3	H3	66.5°	65.2°
C3	C2	C1	O1	68.5°	55.8°
C3	C2	C1	H11	56.7°	175.8°
C3	C2	C1	H12	166.2°	64.2°
C2	C3	O3	C4	121.6°	120.0°
C2	C3	O3	H3	119.3°	120.0°
C2	C3	C4	H3	119.3°	120.0°
C2	C3	O3	HO3	180.0°	54.0°
C2	C3	C4	O4	63.6°	56.2°
C2	C3	C4	C5	175.4°	176.3°
C2	C3	C4	H4	56.7°	63.8°
H2	C2	C1	O1	172.7°	175.9°
H2	C2	C1	H11	62.0°	64.2°
H2	C2	C1	H12	47.5°	55.8°
H2	C2	C3	O3	64.7°	65.2°
H2	C2	C3	C4	56.1°	54.8°
H2	C2	C3	H3	175.1°	174.8°
O1	C1	H11	H12	117.8°	120.0°
H11	C1	O1	HO1	54.8°	60.0°
H12	C1	O1	HO1	54.7°	59.9°
O3	C3	C4	H3	120.3°	120.0°
O3	C3	C4	O4	56.8°	63.8°
O3	C3	C4	C5	64.2°	56.3°
O3	C3	C4	H4	177.1°	176.2°
C4	C3	O3	HO3	58.4°	66.0°
C3	C4	O4	C5	122.2°	120.0°
C3	C4	O4	H4	119.0°	120.0°
C3	C4	C5	H4	118.9°	120.0°
C3	C4	O4	HO4	180.0°	60.0°
C3	C4	C5	O5	57.4°	59.9°
C3	C4	C5	C6	178.1°	180.0°
C3	C4	C5	H5	62.6°	60.0°
H3	C3	O3	HO3	60.6°	174.0°
H3	C3	C4	O4	177.1°	176.2°
H3	C3	C4	C5	56.1°	63.7°
H3	C3	C4	H4	62.6°	56.2°
O4	C4	C5	H4	120.3°	120.0°
O4	C4	C5	O5	178.2°	180.0°
O4	C4	C5	C6	61.1°	60.0°
O4	C4	C5	H5	58.2°	60.0°
C5	C4	O4	HO4	57.7°	60.0°
C4	C5	O5	C6	121.8°	120.0°
C4	C5	O5	H5	118.8°	119.9°
C4	C5	C6	H5	118.8°	120.0°
C4	C5	O5	HO5	180.0°	60.1°
C4	C5	C6	O6	176.6°	175.0°
C4	C5	C6	H61	51.3°	55.0°
C4	C5	C6	H62	58.2°	65.1°
H4	C4	O4	HO4	61.0°	180.0°
H4	C4	C5	O5	61.5°	60.0°
H4	C4	C5	C6	59.2°	60.0°
H4	C4	C5	H5	178.5°	180.0°
O5	C5	C6	H5	120.0°	120.0°
O5	C5	C6	O6	55.4°	65.0°
O5	C5	C6	H61	69.8°	175.0°
O5	C5	C6	H62	179.3°	55.0°
C6	C5	O5	HO5	58.2°	59.9°
C5	C6	O6	H61	125.3°	120.0°
C5	C6	O6	H62	125.3°	120.0°
C5	C6	H61	H62	118.1°	120.1°
C5	C6	O6	HO6	180.0°	180.0°
H5	C5	O5	HO5	61.1°	180.0°
H5	C5	C6	O6	64.6°	55.0°
H5	C5	C6	H61	170.1°	65.0°
H5	C5	C6	H62	60.6°	175.0°
O6	C6	H61	H62	118.1°	120.0°
H61	C6	O6	HO6	54.7°	60.0°
H62	C6	O6	HO6	54.7°	60.0°

Definition date:	2004-10-27
Last modified:	2021-03-01
Release status:	REL
Processing site:	RCSB
Derived from:	1XUZ