V75

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O6B	C6	doub	1.21Å	1.26Å
O5	C1	sing	1.43Å	1.40Å
O5	C5	sing	1.43Å	1.40Å
C1	C2	sing	1.53Å	1.53Å
O6A	C6	sing	1.34Å	1.26Å
C6	C5	sing	1.51Å	1.53Å
C5	C4	sing	1.53Å	1.52Å
C2	O2	sing	1.45Å	1.40Å
C2	C3	sing	1.53Å	1.53Å
O2	C2A	sing	1.34Å	1.40Å
C4	C3	sing	1.53Å	1.53Å
C4	O4	sing	1.43Å	1.40Å
O2B	C2A	doub	1.21Å	1.19Å
C2A	C2B	sing	1.51Å	1.52Å
C3	O3	sing	1.45Å	1.40Å
O3	C3A	sing	1.34Å	1.40Å
C3A	O3B	doub	1.21Å	1.19Å
C3A	C3B	sing	1.51Å	1.53Å
C5	H1	sing	1.09Å	1.10Å
C1	H2	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C2	H4	sing	1.09Å	1.10Å
C3	H5	sing	1.09Å	1.10Å
C4	H6	sing	1.09Å	1.10Å
O4	H7	sing	0.97Å	0.95Å
C2B	H8	sing	1.09Å	1.10Å
C2B	H9	sing	1.09Å	1.10Å
C2B	H10	sing	1.09Å	1.10Å
C3B	H11	sing	1.09Å	1.10Å
C3B	H12	sing	1.09Å	1.10Å
C3B	H13	sing	1.09Å	1.10Å
O6A	H14	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O6B	C6	O6A	119.8°	120.0°
O6B	C6	C5	120.3°	120.0°
C1	O5	C5	112.8°	114.1°
O5	C1	C2	109.1°	109.4°
O5	C1	H2	109.6°	109.6°
O5	C1	H3	109.6°	109.5°
O5	C5	C6	110.7°	109.5°
O5	C5	C4	108.1°	109.4°
O5	C5	H1	110.4°	109.5°
C1	C2	O2	108.1°	109.6°
C1	C2	C3	110.7°	109.2°
C2	C1	H2	109.6°	109.5°
C2	C1	H3	109.6°	109.4°
C1	C2	H4	109.2°	109.5°
O6A	C6	C5	119.9°	120.0°
C6	O6A	H14	109.5°	117.0°
C6	C5	C4	110.4°	109.4°
C6	C5	H1	108.6°	109.5°
C5	C4	C3	110.1°	109.2°
C5	C4	O4	109.4°	109.5°
C4	C5	H1	108.6°	109.5°
C5	C4	H6	108.9°	109.6°
O2	C2	C3	108.7°	109.5°
C2	O2	C2A	115.9°	117.0°
O2	C2	H4	111.0°	109.5°
C2	C3	C4	112.6°	109.0°
C2	C3	O3	109.1°	109.6°
C3	C2	H4	109.2°	109.6°
C2	C3	H5	108.7°	109.5°
O2	C2A	O2B	120.8°	120.0°
O2	C2A	C2B	119.1°	120.0°
C3	C4	O4	109.0°	109.5°
C4	C3	O3	107.2°	109.5°
C4	C3	H5	108.7°	109.6°
C3	C4	H6	108.8°	109.5°
O4	C4	H6	110.6°	109.6°
C4	O4	H7	109.5°	114.0°
O2B	C2A	C2B	120.1°	120.0°
C2A	C2B	H8	109.5°	109.4°
C2A	C2B	H9	109.5°	109.4°
C2A	C2B	H10	109.5°	109.5°
C3	O3	C3A	115.1°	117.0°
O3	C3	H5	110.6°	109.5°
O3	C3A	O3B	120.5°	120.1°
O3	C3A	C3B	119.3°	120.0°
O3B	C3A	C3B	120.2°	120.0°
C3A	C3B	H11	109.5°	109.5°
C3A	C3B	H12	109.5°	109.5°
C3A	C3B	H13	109.4°	109.5°
H2	C1	H3	109.5°	109.5°
H8	C2B	H9	109.5°	109.5°
H8	C2B	H10	109.4°	109.5°
H9	C2B	H10	109.5°	109.5°
H11	C3B	H12	109.5°	109.4°
H11	C3B	H13	109.5°	109.5°
H12	C3B	H13	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O6B	C6	C5	O5	63.2°	5.1°
O6B	C6	O6A	C5	179.8°	179.8°
O6B	C6	C5	C4	56.5°	114.8°
O6B	C6	C5	H1	175.4°	125.2°
O6B	C6	O6A	H14	0.0°	0.3°
O5	C1	C2	H2	119.9°	120.1°
O5	C1	C2	H3	119.9°	119.9°
C1	O5	C5	C6	169.7°	178.9°
C1	O5	C5	C4	69.3°	61.1°
O5	C1	C2	O2	171.6°	177.5°
O5	C1	C2	C3	52.7°	57.6°
C1	O5	C5	H1	49.5°	58.8°
O5	C1	H2	H3	120.2°	120.0°
O5	C1	C2	H4	67.5°	62.4°
C5	O5	C1	C2	67.4°	61.1°
O5	C5	C6	O6A	116.9°	175.0°
O5	C5	C6	C4	119.7°	119.9°
O5	C5	C6	H1	121.3°	120.1°
O5	C5	C4	H1	119.8°	120.0°
O5	C5	C4	C3	56.3°	57.6°
O5	C5	C4	O4	176.1°	177.5°
C5	O5	C1	H2	52.5°	178.9°
C5	O5	C1	H3	172.7°	58.8°
O5	C5	C4	H6	62.9°	62.3°
C1	C2	O2	C3	120.2°	119.7°
C1	C2	O2	H4	119.7°	120.1°
C1	C2	C3	H4	120.2°	119.9°
C1	C2	O2	C2A	147.5°	90.0°
C1	C2	C3	C4	44.8°	56.9°
C1	C2	C3	O3	163.7°	176.8°
C2	C1	H2	H3	120.2°	120.0°
C1	C2	C3	H5	75.7°	63.0°
O6A	C6	C5	C4	123.4°	65.0°
O6A	C6	C5	H1	4.4°	54.9°
C6	C5	C4	H1	118.9°	120.0°
C6	C5	C4	C3	177.6°	177.6°
C6	C5	C4	O4	62.7°	62.5°
C6	C5	C4	H6	58.3°	57.7°
C5	C6	O6A	H14	179.8°	179.9°
C5	C4	C3	C2	46.7°	57.0°
C5	C4	C3	O4	120.0°	119.9°
C5	C4	C3	H6	119.3°	119.9°
C5	C4	O4	H6	119.9°	120.2°
C5	C4	C3	O3	166.6°	176.9°
C5	C4	C3	H5	73.9°	62.9°
C5	C4	O4	H7	180.0°	60.0°
O2	C2	C3	H4	121.2°	120.1°
O2	C2	C3	C4	163.4°	176.9°
C2	O2	C2A	O2B	4.5°	0.0°
C2	O2	C2A	C2B	174.7°	180.0°
O2	C2	C3	O3	77.8°	63.2°
O2	C2	C1	H2	51.7°	62.5°
O2	C2	C1	H3	68.4°	57.5°
O2	C2	C3	H5	42.8°	57.0°
C3	C2	O2	C2A	92.3°	150.3°
C2	C3	C4	O3	119.9°	119.9°
C2	C3	C4	H5	120.6°	119.9°
C2	C3	C4	O4	166.6°	176.9°
C2	C3	O3	H5	119.5°	120.2°
C2	C3	O3	C3A	103.9°	150.0°
C3	C2	C1	H2	67.3°	177.6°
C3	C2	C1	H3	172.6°	62.4°
C2	C3	C4	H6	72.6°	63.0°
O2	C2A	O2B	C2B	179.2°	180.0°
C2A	O2	C2	H4	27.7°	30.2°
O2	C2A	C2B	H8	179.3°	0.0°
O2	C2A	C2B	H9	59.3°	120.0°
O2	C2A	C2B	H10	60.8°	120.0°
C3	C4	O4	H6	119.6°	120.1°
C4	C3	O3	H5	118.3°	120.3°
C4	C3	O3	C3A	133.9°	90.4°
C3	C4	C5	H1	63.5°	62.4°
C4	C3	C2	H4	75.4°	63.0°
C3	C4	O4	H7	59.5°	179.7°
O4	C4	C3	O3	73.4°	63.2°
O4	C4	C5	H1	56.3°	57.5°
O4	C4	C3	H5	46.1°	57.0°
O2B	C2A	C2B	H8	0.0°	180.0°
O2B	C2A	C2B	H9	120.0°	60.0°
O2B	C2A	C2B	H10	120.0°	60.0°
C2A	C2B	H8	H9	120.0°	119.9°
C2A	C2B	H8	H10	120.0°	120.0°
C2A	C2B	H9	H10	120.0°	120.0°
C3	O3	C3A	O3B	1.0°	0.0°
C3	O3	C3A	C3B	178.6°	180.0°
O3	C3	C2	H4	43.5°	56.9°
O3	C3	C4	H6	47.3°	56.9°
O3	C3A	O3B	C3B	179.6°	180.0°
C3A	O3	C3	H5	15.6°	29.8°
O3	C3A	C3B	H11	179.6°	90.0°
O3	C3A	C3B	H12	60.4°	150.0°
O3	C3A	C3B	H13	59.6°	30.0°
O3B	C3A	C3B	H11	0.0°	90.0°
O3B	C3A	C3B	H12	120.0°	30.0°
O3B	C3A	C3B	H13	120.0°	150.0°
C3A	C3B	H11	H12	120.0°	120.0°
C3A	C3B	H11	H13	120.0°	120.0°
C3A	C3B	H12	H13	120.0°	120.0°
H1	C5	C4	H6	177.3°	177.7°
H2	C1	C2	H4	172.6°	57.6°
H3	C1	C2	H4	52.4°	177.6°
H4	C2	C3	H5	164.1°	177.1°
H5	C3	C4	H6	166.8°	177.2°
H6	C4	O4	H7	60.1°	60.2°
H8	C2B	H9	H10	120.0°	120.1°
H11	C3B	H12	H13	120.0°	120.0°

Release date:	2022-03-02
Definition date:	2021-04-21
Last modified:	2022-02-25
Release status:	REL
Processing site:	PDBE
Derived from:	7O0W