A0K

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O13	C12	sing	1.43Å	1.39Å
C10	O11	sing	1.43Å	1.41Å
C10	C09	sing	1.53Å	1.54Å
C12	C09	sing	1.53Å	1.52Å
C09	O1	sing	1.43Å	1.42Å
O1	C1	sing	1.43Å	1.43Å
C6	C5	sing	1.53Å	1.55Å
C6	O6	sing	1.43Å	1.42Å
C5	O5	sing	1.43Å	1.44Å
C5	C4	sing	1.53Å	1.55Å
O5	C1	sing	1.43Å	1.43Å
C1	C2	sing	1.53Å	1.54Å
O4	C4	sing	1.43Å	1.43Å
C4	C3	sing	1.53Å	1.54Å
C3	C2	sing	1.53Å	1.52Å
C3	O3	sing	1.43Å	1.41Å
C2	O2	sing	1.43Å	1.41Å
C10	H1A	sing	1.09Å	1.10Å
C10	H2A	sing	1.09Å	1.10Å
C6	H61	sing	1.09Å	1.10Å
C6	H62	sing	1.09Å	1.10Å
C5	H5	sing	1.09Å	1.10Å
C4	H4	sing	1.09Å	1.10Å
C3	H3	sing	1.09Å	1.10Å
C2	H2	sing	1.09Å	1.10Å
C1	H1	sing	1.09Å	1.10Å
C09	H10	sing	1.09Å	1.10Å
C12	H11	sing	1.09Å	1.10Å
C12	H12	sing	1.09Å	1.10Å
O11	H13	sing	0.97Å	0.95Å
O13	H14	sing	0.97Å	0.95Å
O2	HO2	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)
O13	C12	C09	106.6°	109.5°
O13	C12	H11	110.2°	109.4°
O13	C12	H12	110.2°	109.6°
C12	O13	H14	109.5°	114.0°
O11	C10	C09	113.0°	109.5°
O11	C10	H1A	108.6°	109.5°
O11	C10	H2A	108.6°	109.5°
C10	O11	H13	109.5°	114.1°
C10	C09	C12	111.2°	109.5°
C10	C09	O1	110.5°	109.5°
C09	C10	H1A	108.5°	109.5°
C09	C10	H2A	108.6°	109.5°
C10	C09	H10	108.0°	109.5°
C12	C09	O1	109.2°	109.4°
C12	C09	H10	108.3°	109.5°
C09	C12	H11	110.2°	109.4°
C09	C12	H12	110.2°	109.4°
C09	O1	C1	122.5°	114.0°
O1	C09	H10	109.7°	109.4°
O1	C1	O5	113.4°	109.5°
O1	C1	C2	107.0°	109.5°
O1	C1	H1	109.0°	109.5°
C5	C6	O6	111.7°	109.4°
C6	C5	O5	107.6°	109.5°
C6	C5	C4	111.0°	109.5°
C5	C6	H61	108.9°	109.4°
C5	C6	H62	108.9°	109.5°
C6	C5	H5	107.9°	109.5°
O6	C6	H61	108.9°	109.5°
O6	C6	H62	108.9°	109.5°
C6	O6	HO6	109.5°	114.0°
O5	C5	C4	113.1°	109.4°
C5	O5	C1	113.7°	114.1°
O5	C5	H5	109.3°	109.5°
C5	C4	O4	107.8°	109.5°
C5	C4	C3	109.8°	109.2°
C4	C5	H5	107.9°	109.5°
C5	C4	H4	108.4°	109.5°
O5	C1	C2	110.4°	109.4°
O5	C1	H1	109.1°	109.5°
C1	C2	C3	108.5°	109.2°
C1	C2	O2	109.5°	109.5°
C1	C2	H2	108.3°	109.6°
C2	C1	H1	107.7°	109.4°
O4	C4	C3	112.1°	109.5°
O4	C4	H4	110.1°	109.6°
C4	O4	HO4	109.5°	114.0°
C4	C3	C2	114.2°	109.0°
C4	C3	O3	113.0°	109.6°
C3	C4	H4	108.6°	109.5°
C4	C3	H3	105.6°	109.5°
C2	C3	O3	110.6°	109.5°
C3	C2	O2	111.9°	109.5°
C2	C3	H3	105.8°	109.6°
C3	C2	H2	108.6°	109.5°
O3	C3	H3	107.1°	109.6°
C3	O3	HO3	109.5°	114.0°
O2	C2	H2	109.9°	109.5°
C2	O2	HO2	109.5°	114.0°
H1A	C10	H2A	109.5°	109.5°
H61	C6	H62	109.4°	109.5°
H11	C12	H12	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O13	C12	C09	C10	16.4°	55.0°
O13	C12	C09	H11	119.5°	120.0°
O13	C12	C09	H12	119.5°	120.1°
O13	C12	C09	O1	138.6°	65.0°
O13	C12	C09	H10	102.1°	175.1°
O13	C12	H11	H12	121.3°	120.1°
O11	C10	C09	H1A	120.5°	120.0°
O11	C10	C09	H2A	120.5°	120.0°
O11	C10	C09	C12	173.6°	55.0°
O11	C10	C09	O1	65.0°	65.0°
O11	C10	H1A	H2A	118.4°	120.0°
O11	C10	C09	H10	54.9°	175.1°
C10	C09	C12	O1	122.2°	120.0°
C10	C09	C12	H10	118.5°	120.1°
C10	C09	O1	H10	118.9°	120.0°
C10	C09	O1	C1	176.3°	150.0°
C09	C10	H1A	H2A	118.4°	120.0°
C10	C09	C12	H11	103.1°	175.0°
C10	C09	C12	H12	135.9°	65.1°
C09	C10	O11	H13	180.0°	180.0°
C12	C09	O1	H10	118.5°	120.0°
C12	C09	O1	C1	61.0°	90.0°
C12	C09	C10	H1A	65.9°	65.0°
C12	C09	C10	H2A	53.0°	175.0°
C09	C12	H11	H12	121.4°	119.9°
C09	C12	O13	H14	180.0°	179.9°
C09	O1	C1	O5	53.7°	70.1°
C09	O1	C1	C2	175.7°	170.0°
O1	C09	C10	H1A	55.5°	175.0°
O1	C09	C10	H2A	174.4°	55.0°
C09	O1	C1	H1	68.1°	50.0°
O1	C09	C12	H11	19.1°	55.0°
O1	C09	C12	H12	101.9°	174.9°
O1	C1	O5	C5	58.2°	58.7°
O1	C1	O5	C2	120.1°	120.0°
O1	C1	O5	H1	121.7°	120.1°
O1	C1	C2	H1	117.1°	120.0°
O1	C1	C2	C3	65.6°	62.4°
O1	C1	C2	O2	56.9°	57.5°
O1	C1	C2	H2	176.8°	177.7°
C1	O1	C09	H10	57.4°	30.0°
C5	C6	O6	H61	120.3°	120.0°
C5	C6	O6	H62	120.4°	120.0°
C6	C5	O5	C4	123.0°	119.9°
C6	C5	O5	H5	116.9°	120.1°
C6	C5	C4	H5	118.0°	120.1°
C6	C5	O5	C1	179.5°	178.8°
C6	C5	C4	O4	69.5°	62.5°
C6	C5	C4	C3	168.2°	177.6°
C5	C6	H61	H62	119.0°	120.0°
C6	C5	C4	H4	49.7°	57.6°
C5	C6	O6	HO6	180.0°	180.0°
O6	C6	C5	O5	65.7°	65.0°
O6	C6	C5	C4	58.5°	175.1°
O6	C6	H61	H62	119.0°	120.1°
O6	C6	C5	H5	176.5°	55.0°
O5	C5	C4	H5	121.0°	120.0°
C5	O5	C1	C2	61.9°	61.2°
O5	C5	C4	O4	169.5°	177.5°
O5	C5	C4	C3	47.1°	57.7°
O5	C5	C6	H61	54.6°	175.0°
O5	C5	C6	H62	173.9°	55.0°
O5	C5	C4	H4	71.4°	62.3°
C5	O5	C1	H1	180.0°	178.8°
C4	C5	O5	C1	56.5°	61.2°
C5	C4	O4	C3	120.9°	119.7°
C5	C4	O4	H4	118.1°	120.2°
C5	C4	C3	H4	118.4°	119.9°
C5	C4	C3	C2	47.4°	57.0°
C5	C4	C3	O3	174.8°	176.9°
C4	C5	C6	H61	178.9°	55.1°
C4	C5	C6	H62	61.8°	64.9°
C5	C4	C3	H3	68.5°	62.9°
C5	C4	O4	HO4	180.0°	180.0°
O5	C1	C2	H1	119.0°	120.0°
O5	C1	C2	C3	58.3°	57.6°
O5	C1	C2	O2	179.3°	177.5°
C1	O5	C5	H5	63.7°	58.8°
O5	C1	C2	H2	59.4°	62.3°
C1	C2	C3	C4	52.9°	57.0°
C1	C2	C3	O2	121.0°	119.9°
C1	C2	C3	H2	117.5°	120.0°
C1	C2	C3	O3	178.4°	176.9°
C1	C2	O2	H2	118.9°	120.2°
C1	C2	C3	H3	62.8°	62.9°
C1	C2	O2	HO2	180.0°	60.4°
O4	C4	C3	H4	121.8°	120.2°
O4	C4	C3	C2	167.1°	176.9°
O4	C4	C3	O3	65.4°	63.2°
O4	C4	C5	H5	48.5°	57.5°
O4	C4	C3	H3	51.3°	57.0°
C4	C3	C2	O3	128.7°	119.9°
C4	C3	C2	H3	115.7°	119.8°
C4	C3	O3	H3	115.8°	120.2°
C4	C3	C2	O2	173.8°	176.9°
C3	C4	C5	H5	73.8°	62.3°
C4	C3	C2	H2	64.6°	63.0°
C4	C3	O3	HO3	180.0°	180.0°
C3	C4	O4	HO4	59.0°	60.3°
C2	C3	O3	H3	114.8°	120.2°
C3	C2	O2	H2	120.8°	120.1°
C2	C3	C4	H4	71.0°	62.9°
C3	C2	C1	H1	177.3°	177.6°
C3	C2	O2	HO2	59.6°	180.0°
C2	C3	O3	HO3	50.7°	60.4°
O3	C3	C2	O2	57.5°	63.2°
O3	C3	C4	H4	56.4°	56.9°
O3	C3	C2	H2	64.1°	56.9°
O2	C2	C3	H3	58.1°	57.0°
O2	C2	C1	H1	60.2°	62.5°
H1A	C10	C09	H10	175.5°	55.0°
H1A	C10	O11	H13	59.5°	60.0°
H2A	C10	C09	H10	65.6°	64.9°
H2A	C10	O11	H13	59.5°	60.0°
H61	C6	C5	H5	63.1°	65.0°
H61	C6	O6	HO6	59.7°	60.0°
H62	C6	C5	H5	56.2°	175.0°
H62	C6	O6	HO6	59.7°	60.0°
H5	C5	C4	H4	167.7°	177.7°
H4	C4	C3	H3	173.1°	177.2°
H4	C4	O4	HO4	61.9°	59.9°
H3	C3	C2	H2	179.7°	177.1°
H3	C3	O3	HO3	64.2°	59.8°
H2	C2	C1	H1	59.7°	57.7°
H2	C2	O2	HO2	61.2°	59.9°
H10	C09	C12	H11	138.4°	64.9°
H10	C09	C12	H12	17.4°	55.0°
H11	C12	O13	H14	60.5°	60.1°
H12	C12	O13	H14	60.5°	59.9°

Release date:	2018-08-29
Definition date:	2017-08-08
Last modified:	2020-07-17
Release status:	REL
Processing site:	EBI
Derived from:	5ONT