5OV

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O7	C7	sing	1.43Å	1.43Å
O1	S1	doub	1.42Å	1.43Å
N1	C1	sing	1.48Å	1.46Å
N1	S1	sing	1.67Å	1.63Å
C7	C1	sing	1.52Å	1.53Å
C7	C6	sing	1.52Å	1.54Å
C1	C2	sing	1.54Å	1.54Å
S1	O3	sing	1.54Å	1.58Å
S1	O2	doub	1.42Å	1.42Å
O6	C6	sing	1.43Å	1.44Å
C6	C5	sing	1.53Å	1.50Å
C2	O3	sing	1.45Å	1.44Å
C2	C3	sing	1.53Å	1.52Å
C5	C3	sing	1.53Å	1.54Å
C5	O5	sing	1.43Å	1.43Å
C3	C4	sing	1.53Å	1.52Å
O4	C4	sing	1.43Å	1.43Å
C1	H2	sing	1.09Å	1.10Å
C2	H3	sing	1.09Å	1.10Å
C3	H4	sing	1.09Å	1.10Å
C4	H5	sing	1.09Å	1.10Å
C4	H6	sing	1.09Å	1.10Å
C5	H8	sing	1.09Å	1.10Å
C6	H10	sing	1.09Å	1.10Å
C7	H12	sing	1.09Å	1.10Å
N1	H1	sing	0.97Å	1.00Å
O4	H7	sing	0.97Å	0.95Å
O5	H9	sing	0.97Å	0.95Å
O6	H11	sing	0.97Å	0.95Å
O7	H13	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O7	C7	C1	110.1°	109.2°
O7	C7	C6	109.8°	109.4°
O7	C7	H12	109.2°	109.2°
C7	O7	H13	109.5°	114.0°
O1	S1	N1	106.1°	107.0°
O1	S1	O3	109.4°	107.0°
O1	S1	O2	119.4°	123.7°
C1	N1	S1	108.8°	103.1°
N1	C1	C7	114.7°	111.4°
N1	C1	C2	101.6°	105.0°
N1	C1	H2	110.0°	109.3°
C1	N1	H1	109.7°	128.4°
N1	S1	O3	98.9°	103.3°
N1	S1	O2	113.2°	107.0°
S1	N1	H1	109.7°	128.4°
C1	C7	C6	112.2°	111.6°
C7	C1	C2	112.4°	112.5°
C7	C1	H2	109.0°	109.3°
C1	C7	H12	107.8°	109.1°
C7	C6	O6	109.1°	109.9°
C7	C6	C5	109.9°	108.8°
C7	C6	H10	108.6°	109.3°
C6	C7	H12	107.7°	108.3°
C1	C2	O3	106.6°	104.4°
C1	C2	C3	113.5°	110.3°
C2	C1	H2	108.9°	109.2°
C1	C2	H3	109.1°	111.4°
O3	S1	O2	107.8°	107.1°
S1	O3	C2	108.9°	104.3°
O6	C6	C5	110.2°	109.6°
O6	C6	H10	109.9°	109.6°
C6	O6	H11	109.5°	114.0°
C6	C5	C3	110.3°	108.7°
C6	C5	O5	109.6°	109.6°
C6	C5	H8	108.3°	109.7°
C5	C6	H10	109.1°	109.6°
O3	C2	C3	107.8°	106.7°
O3	C2	H3	110.4°	111.5°
C2	C3	C5	115.2°	110.5°
C2	C3	C4	108.3°	109.3°
C3	C2	H3	109.3°	112.1°
C2	C3	H4	106.6°	109.3°
C3	C5	O5	111.5°	109.6°
C5	C3	C4	113.3°	109.2°
C5	C3	H4	106.4°	109.3°
C3	C5	H8	107.8°	109.6°
O5	C5	H8	109.2°	109.6°
C5	O5	H9	109.5°	114.1°
C3	C4	O4	110.6°	109.5°
C4	C3	H4	106.6°	109.3°
C3	C4	H5	109.2°	109.5°
C3	C4	H6	109.2°	109.5°
O4	C4	H5	109.2°	109.5°
O4	C4	H6	109.2°	109.4°
C4	O4	H7	109.5°	114.0°
H5	C4	H6	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O7	C7	C1	N1	59.5°	57.3°
O7	C7	C1	C6	122.6°	121.1°
O7	C7	C1	H12	119.0°	119.2°
O7	C7	C6	H12	118.8°	118.9°
O7	C7	C1	C2	174.8°	174.9°
O7	C7	C6	O6	56.2°	60.3°
O7	C7	C6	C5	177.2°	179.7°
O7	C7	C1	H2	64.4°	63.6°
O7	C7	C6	H10	63.5°	60.0°
O1	S1	N1	C1	95.4°	111.8°
O1	S1	N1	O3	113.3°	112.7°
O1	S1	N1	O2	132.8°	134.4°
O1	S1	O3	O2	131.3°	134.5°
O1	S1	O3	C2	118.1°	138.5°
O1	S1	N1	H1	24.6°	68.1°
C1	N1	S1	H1	119.9°	180.0°
N1	C1	C7	C2	115.3°	117.6°
N1	C1	C7	H2	123.8°	120.9°
N1	C1	C7	C6	63.1°	63.8°
N1	C1	C2	H2	116.0°	117.1°
C1	N1	S1	O3	18.0°	0.9°
C1	N1	S1	O2	131.8°	113.8°
N1	C1	C2	O3	39.6°	44.5°
N1	C1	C2	C3	79.0°	69.8°
N1	C1	C2	H3	158.8°	165.0°
N1	C1	C7	H12	178.5°	176.5°
S1	N1	C1	C7	156.1°	147.8°
S1	N1	C1	C2	34.6°	25.8°
N1	S1	O3	O2	118.0°	112.8°
N1	S1	O3	C2	7.4°	25.8°
S1	N1	C1	H2	80.6°	91.3°
C1	C7	C6	H12	118.5°	120.2°
C7	C1	C2	H2	120.9°	121.5°
C1	C7	C6	O6	179.0°	178.8°
C1	C7	C6	C5	60.1°	58.7°
C7	C1	C2	O3	162.7°	165.8°
C7	C1	C2	C3	44.1°	51.6°
C7	C1	C2	H3	78.1°	73.7°
C1	C7	C6	H10	59.2°	60.9°
C7	C1	N1	H1	84.0°	32.2°
C1	C7	O7	H13	180.0°	180.0°
C6	C7	C1	C2	52.2°	53.8°
C7	C6	O6	C5	120.8°	119.5°
C7	C6	O6	H10	119.0°	120.1°
C7	C6	C5	H10	119.0°	119.4°
C7	C6	C5	C3	58.2°	62.4°
C7	C6	C5	O5	178.7°	177.8°
C6	C7	C1	H2	173.0°	175.3°
C7	C6	C5	H8	59.6°	57.4°
C7	C6	O6	H11	180.0°	60.4°
C6	C7	O7	H13	56.0°	57.6°
C1	C2	O3	S1	29.0°	42.9°
C1	C2	O3	C3	122.2°	116.8°
C1	C2	O3	H3	118.4°	120.4°
C1	C2	C3	H3	122.1°	124.8°
C1	C2	C3	C5	44.6°	55.8°
C1	C2	C3	C4	172.7°	176.0°
C1	C2	C3	H4	73.1°	64.5°
C2	C1	C7	H12	66.2°	65.8°
C2	C1	N1	H1	154.6°	154.2°
S1	O3	C2	C3	93.2°	73.9°
S1	O3	C2	H3	147.4°	163.3°
O3	S1	N1	H1	137.9°	179.1°
O2	S1	O3	C2	110.6°	87.0°
O2	S1	N1	H1	108.3°	66.3°
O6	C6	C5	H10	120.7°	120.3°
O6	C6	C5	C3	178.5°	177.3°
O6	C6	C5	O5	58.4°	57.6°
O6	C6	C5	H8	60.7°	62.8°
O6	C6	C7	H12	62.6°	58.6°
C6	C5	C3	C2	52.0°	61.8°
C6	C5	C3	O5	122.0°	119.8°
C6	C5	C3	H8	118.1°	119.9°
C6	C5	O5	H8	118.5°	120.5°
C6	C5	C3	C4	177.4°	178.0°
C6	C5	C3	H4	65.8°	58.4°
C5	C6	C7	H12	58.4°	61.4°
C6	C5	O5	H9	180.0°	60.7°
C5	C6	O6	H11	59.2°	180.0°
O3	C2	C3	H3	120.0°	122.4°
O3	C2	C3	C5	162.5°	168.5°
O3	C2	C3	C4	69.5°	71.2°
O3	C2	C1	H2	76.4°	72.6°
O3	C2	C3	H4	44.8°	48.3°
C2	C3	C5	C4	125.4°	120.2°
C2	C3	C5	H4	117.8°	120.2°
C2	C3	C5	O5	174.0°	178.4°
C2	C3	C4	H4	114.3°	119.5°
C2	C3	C4	O4	65.5°	175.0°
C3	C2	C1	H2	165.0°	173.1°
C2	C3	C4	H5	54.6°	65.0°
C2	C3	C4	H6	174.3°	55.0°
C2	C3	C5	H8	66.1°	58.1°
C3	C5	O5	H8	119.1°	120.3°
C5	C3	C4	H4	116.6°	119.5°
C5	C3	C4	O4	63.5°	64.0°
C5	C3	C2	H3	77.4°	69.1°
C5	C3	C4	H5	176.3°	56.0°
C5	C3	C4	H6	56.7°	176.0°
C3	C5	C6	H10	60.8°	57.0°
C3	C5	O5	H9	57.6°	180.0°
O5	C5	C3	C4	60.6°	58.2°
O5	C5	C3	H4	56.2°	61.3°
O5	C5	C6	H10	62.3°	62.7°
C3	C4	O4	H5	120.1°	120.0°
C3	C4	O4	H6	120.2°	120.0°
C4	C3	C2	H3	50.6°	51.1°
C3	C4	H5	H6	119.5°	120.0°
C4	C3	C5	H8	59.3°	62.1°
C3	C4	O4	H7	180.0°	180.0°
O4	C4	C3	H4	179.8°	55.5°
O4	C4	H5	H6	119.5°	120.0°
H2	C1	C2	H3	42.8°	47.9°
H2	C1	C7	H12	54.6°	55.7°
H2	C1	N1	H1	39.3°	88.7°
H3	C2	C3	H4	164.8°	170.7°
H4	C3	C4	H5	59.7°	175.5°
H4	C3	C4	H6	60.0°	64.5°
H4	C3	C5	H8	176.1°	178.3°
H5	C4	O4	H7	59.9°	60.0°
H6	C4	O4	H7	59.8°	60.0°
H8	C5	C6	H10	178.6°	176.9°
H8	C5	O5	H9	61.4°	59.7°
H10	C6	C7	H12	177.7°	178.9°
H10	C6	O6	H11	61.0°	59.7°
H12	C7	O7	H13	61.8°	60.8°

Release date:	2022-07-27
Definition date:	2021-07-13
Last modified:	2022-07-22
Release status:	REL
Processing site:	PDBE
Derived from:	7P4C