8VR

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O3	C3	sing	1.43Å	1.34Å
C3	C4	sing	1.53Å	1.57Å
C3	C2	sing	1.53Å	1.52Å
O8B	C8	doub	1.21Å	1.17Å
O4	C4	sing	1.43Å	1.43Å
O4	C7	sing	1.43Å	1.56Å
O2	C2	sing	1.43Å	1.33Å
C4	C5	sing	1.53Å	1.51Å
C2	C1	sing	1.53Å	1.45Å
C8	C7	sing	1.51Å	1.50Å
C8	O8A	sing	1.34Å	1.18Å
C9	C7	sing	1.53Å	1.53Å
C7	O6	sing	1.43Å	1.37Å
C5	O5	sing	1.43Å	1.37Å
C5	C6	sing	1.53Å	1.45Å
C1	O5	sing	1.43Å	1.29Å
C1	O1	sing	1.43Å	1.33Å
O6	C6	sing	1.43Å	1.32Å
C1	H1	sing	1.09Å	1.10Å
C2	H2	sing	1.09Å	1.10Å
C3	H3	sing	1.09Å	1.10Å
C4	H4	sing	1.09Å	1.10Å
C5	H5	sing	1.09Å	1.10Å
C6	H6	sing	1.09Å	1.10Å
C6	H7	sing	1.09Å	1.10Å
C9	H8	sing	1.09Å	1.10Å
C9	H9	sing	1.09Å	1.10Å
C9	H10	sing	1.09Å	1.10Å
O1	H11	sing	0.97Å	0.95Å
O2	H12	sing	0.97Å	0.95Å
O3	H13	sing	0.97Å	0.95Å
O8A	H14	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O3	C3	C4	114.5°	109.5°
O3	C3	C2	109.0°	109.5°
O3	C3	H3	108.0°	109.5°
C3	O3	H13	109.5°	113.9°
C4	C3	C2	113.4°	109.3°
C3	C4	O4	120.8°	109.8°
C3	C4	C5	106.8°	109.6°
C4	C3	H3	105.4°	109.5°
C3	C4	H4	105.1°	109.5°
C3	C2	O2	106.8°	109.6°
C3	C2	C1	108.8°	109.0°
C3	C2	H2	110.3°	109.6°
C2	C3	H3	105.9°	109.5°
O8B	C8	C7	116.8°	120.0°
O8B	C8	O8A	120.7°	120.0°
C4	O4	C7	118.2°	113.7°
O4	C4	C5	110.8°	109.0°
O4	C4	H4	106.6°	109.4°
O4	C7	C8	113.0°	109.5°
O4	C7	C9	107.0°	109.4°
O4	C7	O6	117.8°	109.5°
O2	C2	C1	106.0°	109.6°
O2	C2	H2	113.3°	109.5°
C2	O2	H12	109.5°	114.0°
C4	C5	O5	112.4°	109.5°
C4	C5	C6	110.6°	108.6°
C5	C4	H4	105.7°	109.5°
C4	C5	H5	106.8°	109.7°
C2	C1	O5	106.0°	109.3°
C2	C1	O1	113.6°	109.5°
C2	C1	H1	111.4°	109.6°
C1	C2	H2	111.3°	109.6°
C7	C8	O8A	122.0°	120.0°
C8	C7	C9	106.0°	109.5°
C8	C7	O6	107.8°	109.4°
C8	O8A	H14	109.5°	117.0°
C9	C7	O6	104.2°	109.5°
C7	C9	H8	109.5°	109.4°
C7	C9	H9	109.4°	109.5°
C7	C9	H10	109.5°	109.5°
C7	O6	C6	115.6°	113.9°
O5	C5	C6	110.7°	108.9°
C5	O5	C1	102.0°	114.4°
O5	C5	H5	108.6°	109.7°
C5	C6	O6	111.6°	108.8°
C6	C5	H5	107.5°	110.4°
C5	C6	H6	108.9°	109.6°
C5	C6	H7	108.9°	109.6°
O5	C1	O1	97.2°	109.5°
O5	C1	H1	114.4°	109.5°
O1	C1	H1	113.4°	109.5°
C1	O1	H11	109.5°	114.0°
O6	C6	H6	108.9°	109.6°
O6	C6	H7	108.9°	109.6°
H6	C6	H7	109.5°	109.6°
H8	C9	H9	109.5°	109.5°
H8	C9	H10	109.5°	109.5°
H9	C9	H10	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O3	C3	C4	C2	126.0°	120.0°
O3	C3	C4	H3	118.6°	120.1°
O3	C3	C2	H3	116.0°	120.1°
O3	C3	C4	O4	27.9°	56.4°
O3	C3	C2	O2	78.6°	63.2°
O3	C3	C4	C5	155.6°	176.2°
O3	C3	C2	C1	167.4°	176.9°
O3	C3	C2	H2	44.9°	57.0°
O3	C3	C4	H4	92.4°	63.7°
C4	C3	C2	H3	115.1°	119.9°
C3	C4	O4	C5	125.9°	120.1°
C3	C4	O4	H4	119.6°	120.1°
C3	C4	O4	C7	124.5°	178.2°
C4	C3	C2	O2	152.5°	176.9°
C3	C4	C5	H4	111.6°	120.1°
C4	C3	C2	C1	38.5°	57.0°
C3	C4	C5	O5	47.6°	56.3°
C3	C4	C5	C6	172.0°	175.2°
C4	C3	C2	H2	83.9°	62.9°
C3	C4	C5	H5	71.3°	64.1°
C4	C3	O3	H13	180.0°	180.0°
C2	C3	C4	O4	98.1°	63.6°
C3	C2	O2	C1	115.9°	119.6°
C3	C2	O2	H2	121.7°	120.2°
C2	C3	C4	C5	29.7°	56.2°
C3	C2	C1	H2	121.8°	119.9°
C3	C2	C1	O5	67.0°	58.0°
C3	C2	C1	O1	172.4°	177.9°
C3	C2	C1	H1	58.0°	61.9°
C2	C3	C4	H4	141.6°	176.3°
C3	C2	O2	H12	180.0°	179.5°
C2	C3	O3	H13	51.8°	60.2°
O8B	C8	C7	O4	20.3°	5.0°
O8B	C8	C7	O8A	171.5°	179.9°
O8B	C8	C7	C9	96.6°	125.0°
O8B	C8	C7	O6	152.2°	115.0°
O8B	C8	O8A	H14	0.0°	0.0°
O4	C4	C5	H4	115.1°	119.7°
C4	O4	C7	C8	145.1°	61.6°
C4	O4	C7	C9	98.6°	178.4°
C4	O4	C7	O6	18.3°	58.4°
O4	C4	C5	O5	85.7°	63.9°
O4	C4	C5	C6	38.6°	55.0°
O4	C4	C3	H3	146.5°	176.5°
O4	C4	C5	H5	155.3°	175.7°
C7	O4	C4	C5	1.4°	58.1°
O4	C7	C8	C9	116.9°	120.0°
O4	C7	C8	O6	132.0°	120.1°
O4	C7	C8	O8A	168.2°	174.9°
O4	C7	C9	O6	125.5°	120.1°
O4	C7	O6	C6	9.9°	58.5°
C7	O4	C4	H4	115.9°	61.7°
O4	C7	C9	H8	180.0°	179.9°
O4	C7	C9	H9	60.0°	59.9°
O4	C7	C9	H10	60.0°	60.1°
O2	C2	C1	H2	123.6°	120.1°
O2	C2	C1	O5	178.5°	178.0°
O2	C2	C1	O1	73.0°	62.1°
O2	C2	C1	H1	56.6°	58.1°
O2	C2	C3	H3	37.4°	56.9°
C4	C5	O5	C6	124.3°	118.6°
C4	C5	O5	H5	118.0°	120.4°
C4	C5	C6	H5	116.3°	120.3°
C4	C5	O5	C1	77.4°	60.4°
C4	C5	C6	O6	70.5°	54.9°
C5	C4	C3	H3	85.8°	63.7°
C4	C5	C6	H6	169.1°	174.7°
C4	C5	C6	H7	49.8°	65.0°
C2	C1	O5	C5	85.3°	61.4°
C2	C1	O5	O1	117.1°	120.0°
C2	C1	O5	H1	123.1°	120.0°
C2	C1	O1	H1	128.6°	120.2°
C1	C2	C3	H3	76.6°	63.0°
C2	C1	O1	H11	180.0°	179.9°
C1	C2	O2	H12	64.1°	59.9°
C8	C7	C9	O6	113.6°	120.0°
C8	C7	O6	C6	119.4°	61.5°
C8	C7	C9	H8	59.1°	60.0°
C8	C7	C9	H9	60.9°	60.0°
C8	C7	C9	H10	179.1°	179.9°
C7	C8	O8A	H14	171.2°	180.0°
O8A	C8	C7	C9	74.9°	54.9°
O8A	C8	C7	O6	36.3°	65.0°
C9	C7	O6	C6	128.2°	178.5°
C7	C9	H8	H9	120.0°	120.0°
C7	C9	H8	H10	120.0°	120.0°
C7	C9	H9	H10	120.0°	120.0°
C7	O6	C6	C5	53.5°	58.1°
C7	O6	C6	H6	173.8°	177.9°
C7	O6	C6	H7	66.8°	61.8°
O6	C7	C9	H8	54.5°	60.0°
O6	C7	C9	H9	174.5°	180.0°
O6	C7	C9	H10	65.5°	60.0°
O5	C5	C6	H5	118.4°	120.5°
C5	O5	C1	O1	157.6°	178.6°
O5	C5	C6	O6	54.7°	64.4°
C5	O5	C1	H1	37.9°	58.6°
O5	C5	C4	H4	159.2°	176.4°
O5	C5	C6	H6	65.6°	55.5°
O5	C5	C6	H7	175.1°	175.8°
C6	C5	O5	C1	158.3°	179.1°
C5	C6	O6	H6	120.3°	119.9°
C5	C6	O6	H7	120.3°	119.8°
C6	C5	C4	H4	76.5°	64.7°
C5	C6	H6	H7	119.0°	120.3°
O5	C1	O1	H1	120.5°	120.0°
O5	C1	C2	H2	54.9°	61.9°
C1	O5	C5	H5	40.5°	60.0°
O5	C1	O1	H11	69.1°	60.1°
O1	C1	C2	H2	50.6°	58.0°
O6	C6	C5	H5	173.2°	175.1°
O6	C6	H6	H7	119.0°	120.3°
H1	C1	C2	H2	179.8°	178.2°
H1	C1	O1	H11	51.4°	60.0°
H2	C2	C3	H3	160.9°	177.1°
H2	C2	O2	H12	58.3°	60.2°
H3	C3	C4	H4	26.2°	56.4°
H3	C3	O3	H13	62.9°	59.9°
H4	C4	C5	H5	40.2°	56.0°
H5	C5	C6	H6	52.9°	65.0°
H5	C5	C6	H7	66.5°	55.3°
H8	C9	H9	H10	120.0°	120.1°

Release date:	2018-08-29
Definition date:	2017-10-05
Last modified:	2018-08-24
Release status:	REL
Processing site:	PDBJ
Derived from:	5YIF