7N0

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O3	C4	doub	1.21Å	1.20Å
C5	C4	sing	1.52Å	1.49Å
C5	C6	sing	1.55Å	1.52Å
C4	C3	sing	1.51Å	1.48Å
O2	C1	doub	1.21Å	1.24Å
O1	C1	sing	1.34Å	1.26Å
C1	C2	sing	1.51Å	1.51Å
C6	C7	sing	1.55Å	1.53Å
C3	C2	sing	1.53Å	1.52Å
C3	C7	sing	1.54Å	1.52Å
C5	H1	sing	1.09Å	1.10Å
C5	H2	sing	1.09Å	1.10Å
C6	H3	sing	1.09Å	1.10Å
C6	H4	sing	1.09Å	1.10Å
C7	H5	sing	1.09Å	1.10Å
C7	H6	sing	1.09Å	1.10Å
C3	H7	sing	1.09Å	1.10Å
C2	H8	sing	1.09Å	1.10Å
C2	H9	sing	1.09Å	1.10Å
O1	H10	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O3	C4	C5	123.3°	126.3°
O3	C4	C3	123.0°	126.3°
C4	C5	C6	99.9°	104.4°
C5	C4	C3	113.6°	107.3°
C4	C5	H1	111.8°	110.4°
C4	C5	H2	111.8°	110.5°
C5	C6	C7	107.8°	102.3°
C6	C5	H1	111.8°	110.4°
C6	C5	H2	111.8°	110.5°
C5	C6	H3	109.9°	110.8°
C5	C6	H4	109.9°	110.8°
C4	C3	C2	111.9°	110.0°
C4	C3	C7	101.5°	106.8°
C4	C3	H7	111.3°	110.0°
O2	C1	O1	123.8°	120.0°
O2	C1	C2	115.9°	120.0°
O1	C1	C2	120.3°	120.0°
C1	O1	H10	109.5°	117.1°
C1	C2	C3	113.1°	109.5°
C1	C2	H8	108.5°	109.4°
C1	C2	H9	108.6°	109.5°
C6	C7	C3	108.3°	103.9°
C7	C6	H3	109.9°	110.9°
C7	C6	H4	109.9°	110.9°
C6	C7	H5	109.8°	110.6°
C6	C7	H6	109.8°	110.6°
C2	C3	C7	110.5°	110.1°
C2	C3	H7	110.7°	110.0°
C3	C2	H8	108.5°	109.5°
C3	C2	H9	108.6°	109.5°
C3	C7	H5	109.8°	110.7°
C3	C7	H6	109.8°	110.5°
C7	C3	H7	110.7°	109.9°
H1	C5	H2	109.5°	110.5°
H3	C6	H4	109.4°	110.9°
H5	C7	H6	109.5°	110.5°
H8	C2	H9	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O3	C4	C5	C3	175.9°	179.7°
O3	C4	C5	C6	144.4°	156.2°
O3	C4	C3	C2	92.0°	61.0°
O3	C4	C3	C7	150.2°	179.5°
O3	C4	C5	H1	25.9°	37.5°
O3	C4	C5	H2	97.2°	85.0°
O3	C4	C3	H7	32.4°	60.3°
C4	C5	C6	H1	118.4°	118.7°
C4	C5	C6	H2	118.4°	118.8°
C4	C5	C6	C7	23.6°	37.6°
C5	C4	C3	C2	92.1°	118.7°
C5	C4	C3	C7	25.7°	0.8°
C4	C5	H1	H2	124.5°	122.5°
C4	C5	C6	H3	96.2°	80.6°
C4	C5	C6	H4	143.3°	155.9°
C5	C4	C3	H7	143.5°	120.0°
C6	C5	C4	C3	31.5°	24.1°
C5	C6	C7	H3	119.8°	118.2°
C5	C6	C7	H4	119.7°	118.2°
C5	C6	C7	C3	10.0°	36.9°
C6	C5	H1	H2	124.4°	122.5°
C5	C6	H3	H4	120.8°	123.5°
C5	C6	C7	H5	129.8°	155.7°
C5	C6	C7	H6	109.8°	81.6°
C4	C3	C2	C1	66.4°	66.5°
C4	C3	C7	C6	8.5°	22.8°
C4	C3	C2	C7	112.3°	117.5°
C4	C3	C2	H7	124.8°	121.3°
C4	C3	C7	H7	118.2°	119.3°
C3	C4	C5	H1	150.0°	142.7°
C3	C4	C5	H2	86.9°	94.7°
C4	C3	C7	H5	111.4°	141.5°
C4	C3	C7	H6	128.3°	95.8°
C4	C3	C2	H8	54.1°	173.6°
C4	C3	C2	H9	173.0°	53.5°
O2	C1	O1	C2	180.0°	179.9°
O2	C1	C2	C3	155.8°	0.0°
O2	C1	C2	H8	35.3°	120.0°
O2	C1	C2	H9	83.6°	120.0°
O2	C1	O1	H10	0.0°	0.1°
O1	C1	C2	C3	24.2°	180.0°
O1	C1	C2	H8	144.7°	60.1°
O1	C1	C2	H9	96.4°	59.9°
C1	C2	C3	H8	120.5°	119.9°
C1	C2	C3	H9	120.6°	120.0°
C1	C2	C3	C7	178.7°	176.0°
C1	C2	C3	H7	58.4°	54.8°
C1	C2	H8	H9	118.3°	120.0°
C2	C1	O1	H10	180.0°	180.0°
C6	C7	C3	C2	110.4°	142.1°
C6	C7	C3	H5	119.8°	118.7°
C6	C7	C3	H6	119.8°	118.6°
C7	C6	C5	H1	142.0°	156.3°
C7	C6	C5	H2	94.9°	81.1°
C7	C6	H3	H4	120.8°	123.6°
C6	C7	H5	H6	120.5°	122.7°
C6	C7	C3	H7	126.7°	96.5°
C2	C3	C7	H7	123.0°	121.3°
C2	C3	C7	H5	129.8°	99.2°
C2	C3	C7	H6	9.4°	23.6°
C3	C2	H8	H9	118.3°	120.1°
C3	C7	C6	H3	109.7°	81.3°
C3	C7	C6	H4	129.8°	155.1°
C3	C7	H5	H6	120.5°	122.7°
C7	C3	C2	H8	58.2°	56.1°
C7	C3	C2	H9	60.7°	63.9°
H1	C5	C6	H3	22.3°	38.1°
H1	C5	C6	H4	98.2°	85.4°
H2	C5	C6	H3	145.4°	160.6°
H2	C5	C6	H4	24.9°	37.1°
H3	C6	C7	H5	10.1°	37.5°
H3	C6	C7	H6	130.4°	160.2°
H4	C6	C7	H5	110.4°	86.1°
H4	C6	C7	H6	9.9°	36.6°
H5	C7	C3	H7	6.8°	22.2°
H6	C7	C3	H7	113.5°	144.9°
H7	C3	C2	H8	178.9°	65.2°
H7	C3	C2	H9	62.2°	174.8°

Release date:	2018-11-07
Definition date:	2016-11-22
Last modified:	2024-09-27
Release status:	REL
Processing site:	EBI
Derived from:	5MGO