8ZO

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O16	S9	doub	1.42Å	1.65Å
C4	C5	doub	1.38Å	1.50Å	Aromatic
C4	C3	sing	1.38Å	1.15Å	Aromatic
S9	C5	sing	1.78Å	1.79Å
S9	O17	doub	1.42Å	1.65Å
S9	C8	sing	1.83Å	2.13Å
C5	C6	sing	1.38Å	1.50Å	Aromatic
C3	C2	doub	1.38Å	0.98Å	Aromatic
C2	C1	sing	1.38Å	1.15Å	Aromatic
C6	C1	doub	1.40Å	1.51Å	Aromatic
C6	C7	sing	1.51Å	1.32Å
C8	C7	sing	1.54Å	1.66Å
C7	C10	sing	1.51Å	1.57Å
C13	C14	sing	1.51Å	1.53Å
C13	O12	sing	1.45Å	1.41Å
C15	C14	doub	1.31Å	1.53Å
C10	O12	sing	1.34Å	1.41Å
C10	O11	doub	1.21Å	1.19Å
C1	H1	sing	1.08Å	1.08Å
C2	H2	sing	1.08Å	1.08Å
C3	H3	sing	1.08Å	1.08Å
C4	H4	sing	1.08Å	1.08Å
C7	H5	sing	1.09Å	1.10Å
C8	H6	sing	1.09Å	1.10Å
C8	H7	sing	1.09Å	1.10Å
C13	H8	sing	1.09Å	1.10Å
C13	H9	sing	1.09Å	1.10Å
C14	H10	sing	1.08Å	1.08Å
C15	H12	sing	1.08Å	1.08Å
C15	H13	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O16	S9	C5	113.6°	105.5°
O16	S9	O17	115.4°	121.9°
O16	S9	C8	111.4°	111.6°
C5	C4	C3	124.8°	120.2°
C4	C5	S9	143.6°	130.7°
C4	C5	C6	108.6°	121.5°
C5	C4	H4	117.6°	119.9°
C4	C3	C2	127.3°	119.1°
C4	C3	H3	116.3°	120.4°
C3	C4	H4	117.6°	119.8°
C5	S9	O17	110.1°	105.5°
C5	S9	C8	91.0°	97.3°
S9	C5	C6	107.8°	107.8°
O17	S9	C8	112.9°	111.6°
S9	C8	C7	103.4°	100.6°
S9	C8	H6	110.9°	111.0°
S9	C8	H7	111.0°	111.3°
C5	C6	C1	105.2°	117.6°
C5	C6	C7	130.6°	115.8°
C3	C2	C1	127.7°	120.4°
C3	C2	H2	116.2°	119.8°
C2	C3	H3	116.4°	120.4°
C2	C1	C6	126.4°	121.1°
C2	C1	H1	116.8°	119.5°
C1	C2	H2	116.1°	119.8°
C1	C6	C7	124.2°	126.6°
C6	C1	H1	116.8°	119.5°
C6	C7	C8	106.2°	110.8°
C6	C7	C10	112.8°	109.2°
C6	C7	H5	112.6°	109.2°
C8	C7	C10	108.3°	109.2°
C8	C7	H5	107.9°	109.2°
C7	C8	H6	111.0°	111.2°
C7	C8	H7	110.9°	111.2°
C7	C10	O12	121.8°	120.0°
C7	C10	O11	118.2°	120.0°
C10	C7	H5	108.9°	109.2°
C14	C13	O12	111.1°	109.4°
C13	C14	C15	114.4°	120.0°
C14	C13	H8	109.1°	109.5°
C14	C13	H9	109.1°	109.5°
C13	C14	H10	122.8°	120.0°
C13	O12	C10	116.9°	117.0°
O12	C13	H8	109.1°	109.5°
O12	C13	H9	109.1°	109.5°
C15	C14	H10	122.9°	120.0°
C14	C15	H12	120.0°	120.0°
C14	C15	H13	120.0°	120.0°
O12	C10	O11	120.1°	120.0°
H6	C8	H7	109.5°	111.1°
H8	C13	H9	109.4°	109.5°
H12	C15	H13	120.0°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O16	S9	C5	C4	71.8°	79.8°
O16	S9	C5	O17	131.1°	130.2°
O16	S9	C5	C8	113.9°	114.9°
O16	S9	O17	C8	129.7°	135.5°
O16	S9	C5	C6	108.9°	100.8°
O16	S9	C8	C7	107.3°	86.0°
O16	S9	C8	H6	11.7°	156.2°
O16	S9	C8	H7	133.7°	31.9°
C5	C4	C3	H4	180.0°	179.8°
C4	C5	S9	C6	179.3°	179.4°
C4	C5	S9	O17	59.3°	50.5°
C4	C5	S9	C8	174.3°	165.3°
C5	C4	C3	C2	0.0°	0.0°
C4	C5	C6	C1	0.2°	0.2°
C4	C5	C6	C7	179.4°	178.8°
C5	C4	C3	H3	180.0°	180.0°
C3	C4	C5	S9	179.5°	179.1°
C3	C4	C5	C6	0.2°	0.3°
C4	C3	C2	H3	180.0°	180.0°
C4	C3	C2	C1	0.2°	0.3°
C4	C3	C2	H2	179.8°	179.8°
C5	S9	O17	C8	100.1°	104.6°
S9	C5	C6	C1	179.8°	179.3°
S9	C5	C6	C7	1.0°	1.7°
C5	S9	C8	C7	8.6°	23.8°
S9	C5	C4	H4	0.5°	1.1°
C5	S9	C8	H6	127.7°	94.0°
C5	S9	C8	H7	110.4°	141.8°
O17	S9	C5	C6	120.0°	128.9°
O17	S9	C8	C7	121.0°	133.8°
O17	S9	C8	H6	120.0°	15.9°
O17	S9	C8	H7	2.0°	108.3°
C8	S9	C5	C6	5.0°	14.1°
S9	C8	C7	C6	9.8°	27.6°
S9	C8	C7	H6	119.0°	117.6°
S9	C8	C7	H7	119.0°	118.0°
S9	C8	C7	C10	131.2°	148.0°
S9	C8	C7	H5	111.0°	92.7°
S9	C8	H6	H7	122.8°	124.4°
C5	C6	C1	C2	0.2°	0.1°
C5	C6	C1	C7	179.2°	178.9°
C5	C6	C7	C8	8.3°	20.9°
C5	C6	C7	C10	126.7°	141.3°
C5	C6	C1	H1	179.8°	179.8°
C6	C5	C4	H4	179.8°	179.5°
C5	C6	C7	H5	109.5°	99.3°
C3	C2	C1	H2	180.0°	179.9°
C3	C2	C1	C6	0.0°	0.3°
C3	C2	C1	H1	180.0°	179.9°
C2	C3	C4	H4	180.0°	179.8°
C2	C1	C6	H1	180.0°	179.7°
C2	C1	C6	C7	179.4°	179.0°
C1	C2	C3	H3	179.8°	179.7°
C1	C6	C7	C8	172.7°	160.1°
C1	C6	C7	C10	54.3°	39.8°
C6	C1	C2	H2	180.0°	179.8°
C1	C6	C7	H5	69.5°	79.6°
C6	C7	C8	C10	121.4°	120.3°
C6	C7	C8	H5	120.9°	120.3°
C6	C7	C10	H5	125.8°	119.3°
C6	C7	C10	O12	97.8°	61.5°
C6	C7	C10	O11	83.0°	118.5°
C7	C6	C1	H1	0.6°	1.3°
C6	C7	C8	H6	128.8°	90.0°
C6	C7	C8	H7	109.2°	145.7°
C8	C7	C10	H5	117.1°	119.3°
C8	C7	C10	O12	145.0°	177.2°
C8	C7	C10	O11	34.2°	2.8°
C7	C8	H6	H7	122.8°	124.4°
C7	C10	O12	C13	10.6°	180.0°
C7	C10	O12	O11	179.2°	180.0°
C10	C7	C8	H6	109.8°	30.3°
C10	C7	C8	H7	12.2°	94.0°
C14	C13	O12	H8	120.2°	120.0°
C14	C13	O12	H9	120.3°	120.0°
C13	C14	C15	H10	180.0°	180.0°
C14	C13	O12	C10	137.8°	180.0°
C14	C13	H8	H9	119.2°	120.0°
C13	C14	C15	H12	180.0°	0.0°
C13	C14	C15	H13	0.0°	180.0°
O12	C13	C14	C15	93.0°	135.0°
C13	O12	C10	O11	170.2°	0.0°
O12	C13	H8	H9	119.3°	120.0°
O12	C13	C14	H10	87.0°	45.0°
C15	C14	C13	H8	146.8°	15.0°
C15	C14	C13	H9	27.3°	105.0°
C14	C15	H12	H13	180.0°	180.0°
O12	C10	C7	H5	28.0°	57.9°
C10	O12	C13	H8	102.0°	60.0°
C10	O12	C13	H9	17.5°	60.0°
O11	C10	C7	H5	151.3°	122.1°
H1	C1	C2	H2	0.0°	0.0°
H2	C2	C3	H3	0.2°	0.2°
H3	C3	C4	H4	0.0°	0.2°
H5	C7	C8	H6	8.0°	149.7°
H5	C7	C8	H7	129.9°	25.4°
H8	C13	C14	H10	33.2°	165.0°
H9	C13	C14	H10	152.7°	75.0°
H10	C14	C15	H12	0.0°	NaN°
H10	C14	C15	H13	180.0°	0.0°

Release date:	2020-08-19
Definition date:	2017-11-13
Last modified:	2024-09-27
Release status:	REL
Processing site:	PDBJ
Derived from:	5YQV