VP0

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C	C1	sing	1.51Å	1.48Å
C1	O	doub	1.21Å	1.20Å
C1	N	sing	1.35Å	1.35Å
C2	N	sing	1.47Å	1.46Å
C2	C3	sing	1.53Å	1.51Å
N	C10	sing	1.47Å	1.47Å
O2	C12	doub	1.21Å	1.22Å
C3	C4	sing	1.51Å	1.51Å
C12	O1	sing	1.34Å	1.23Å
C12	C11	sing	1.51Å	1.52Å
C10	C11	sing	1.53Å	1.53Å
C10	C9	sing	1.51Å	1.51Å
C4	C9	doub	1.38Å	1.40Å	Aromatic
C4	C5	sing	1.39Å	1.39Å	Aromatic
C9	C8	sing	1.39Å	1.39Å	Aromatic
C5	C6	doub	1.38Å	1.38Å	Aromatic
C8	C7	doub	1.38Å	1.38Å	Aromatic
C6	C7	sing	1.38Å	1.37Å	Aromatic
C7	H1	sing	1.08Å	1.08Å
C8	H2	sing	1.08Å	1.08Å
O1	H3	sing	0.97Å	0.95Å
C5	H4	sing	1.08Å	1.08Å
C6	H5	sing	1.08Å	1.08Å
C3	H6	sing	1.09Å	1.10Å
C3	H7	sing	1.09Å	1.10Å
C2	H8	sing	1.09Å	1.10Å
C2	H9	sing	1.09Å	1.10Å
C11	H10	sing	1.09Å	1.10Å
C11	H11	sing	1.09Å	1.10Å
C10	H12	sing	1.09Å	1.10Å
C	H13	sing	1.09Å	1.10Å
C	H14	sing	1.09Å	1.10Å
C	H15	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C	C1	O	121.6°	120.0°
C	C1	N	117.8°	120.0°
C1	C	H13	109.5°	109.5°
C1	C	H14	109.5°	109.4°
C1	C	H15	109.4°	109.5°
O	C1	N	120.5°	120.0°
C1	N	C2	123.0°	121.3°
C1	N	C10	121.5°	121.3°
N	C2	C3	109.6°	108.0°
C2	N	C10	115.5°	117.3°
N	C2	H8	109.4°	109.8°
N	C2	H9	109.5°	109.7°
C2	C3	C4	112.2°	110.9°
C2	C3	H6	108.7°	109.2°
C2	C3	H7	108.8°	109.2°
C3	C2	H8	109.4°	109.8°
C3	C2	H9	109.4°	109.8°
N	C10	C11	111.8°	109.4°
N	C10	C9	111.0°	109.7°
N	C10	H12	108.9°	109.4°
O2	C12	O1	124.2°	120.0°
O2	C12	C11	116.9°	120.0°
C3	C4	C9	121.3°	122.8°
C3	C4	C5	119.7°	117.7°
C4	C3	H6	108.8°	109.1°
C4	C3	H7	108.8°	109.2°
O1	C12	C11	118.9°	120.0°
C12	O1	H3	109.5°	117.0°
C12	C11	C10	112.9°	109.5°
C12	C11	H10	108.6°	109.5°
C12	C11	H11	108.6°	109.5°
C11	C10	C9	108.4°	109.5°
C10	C11	H10	108.6°	109.5°
C10	C11	H11	108.6°	109.5°
C11	C10	H12	108.2°	109.4°
C10	C9	C4	121.9°	122.4°
C10	C9	C8	118.9°	117.8°
C9	C10	H12	108.4°	109.4°
C9	C4	C5	119.0°	119.5°
C4	C9	C8	119.3°	119.8°
C4	C5	C6	120.9°	120.6°
C4	C5	H4	119.6°	119.6°
C9	C8	C7	120.7°	120.5°
C9	C8	H2	119.6°	119.7°
C5	C6	C7	120.2°	119.9°
C6	C5	H4	119.6°	119.8°
C5	C6	H5	119.9°	120.0°
C8	C7	C6	120.0°	119.7°
C8	C7	H1	120.0°	120.1°
C7	C8	H2	119.6°	119.8°
C6	C7	H1	120.0°	120.2°
C7	C6	H5	119.9°	120.1°
H6	C3	H7	109.5°	109.2°
H8	C2	H9	109.5°	109.8°
H10	C11	H11	109.5°	109.4°
H13	C	H14	109.4°	109.5°
H13	C	H15	109.5°	109.5°
H14	C	H15	109.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C	C1	O	N	178.2°	180.0°
C	C1	N	C2	3.0°	3.5°
C	C1	N	C10	177.4°	176.4°
C1	C	H13	H14	120.0°	120.0°
C1	C	H13	H15	120.0°	120.0°
C1	C	H14	H15	120.0°	120.0°
O	C1	N	C2	175.3°	176.5°
O	C1	N	C10	4.4°	3.6°
O	C1	C	H13	0.0°	95.4°
O	C1	C	H14	120.0°	144.6°
O	C1	C	H15	120.0°	24.6°
C1	N	C2	C10	179.7°	179.9°
C1	N	C2	C3	116.8°	115.9°
C1	N	C10	C11	103.3°	104.4°
C1	N	C10	C9	135.6°	135.5°
C1	N	C2	H8	123.3°	3.8°
C1	N	C2	H9	3.3°	124.5°
C1	N	C10	H12	16.3°	15.4°
N	C1	C	H13	178.2°	84.6°
N	C1	C	H14	61.8°	35.4°
N	C1	C	H15	58.2°	155.4°
N	C2	C3	H8	120.0°	119.7°
N	C2	C3	H9	120.0°	119.6°
N	C2	C3	C4	46.8°	47.5°
C2	N	C10	C11	76.4°	75.7°
C2	N	C10	C9	44.7°	44.4°
N	C2	C3	H6	167.2°	72.8°
N	C2	C3	H7	73.6°	167.8°
N	C2	H8	H9	120.0°	120.7°
C2	N	C10	H12	164.1°	164.5°
C3	C2	N	C10	63.6°	64.0°
C2	C3	C4	H6	120.4°	120.4°
C2	C3	C4	H7	120.4°	120.3°
C2	C3	C4	C9	17.8°	20.6°
C2	C3	C4	C5	162.5°	160.4°
C2	C3	H6	H7	118.7°	119.4°
C3	C2	H8	H9	119.9°	120.8°
N	C10	C11	C12	35.2°	64.7°
N	C10	C11	C9	122.6°	120.3°
N	C10	C11	H12	120.0°	119.8°
N	C10	C9	H12	119.6°	120.0°
N	C10	C9	C4	12.5°	12.0°
N	C10	C9	C8	167.6°	168.6°
C10	N	C2	H8	56.4°	176.3°
C10	N	C2	H9	176.4°	55.6°
N	C10	C11	H10	155.7°	175.2°
N	C10	C11	H11	85.3°	55.3°
O2	C12	O1	C11	179.0°	180.0°
O2	C12	C11	C10	47.0°	0.0°
O2	C12	O1	H3	0.0°	0.0°
O2	C12	C11	H10	73.5°	120.1°
O2	C12	C11	H11	167.5°	120.0°
C3	C4	C9	C10	0.4°	2.1°
C3	C4	C9	C5	179.7°	179.0°
C3	C4	C9	C8	179.7°	178.5°
C3	C4	C5	C6	179.8°	178.9°
C3	C4	C5	H4	0.2°	1.2°
C4	C3	H6	H7	118.8°	119.3°
C4	C3	C2	H8	73.2°	167.2°
C4	C3	C2	H9	166.8°	72.1°
O1	C12	C11	C10	133.9°	180.0°
O1	C12	C11	H10	105.6°	60.0°
O1	C12	C11	H11	13.4°	60.0°
C12	C11	C10	H10	120.5°	120.0°
C12	C11	C10	H11	120.5°	120.0°
C12	C11	C10	C9	157.8°	175.0°
C11	C12	O1	H3	179.0°	180.0°
C12	C11	H10	H11	118.5°	120.0°
C12	C11	C10	H12	84.8°	55.1°
C11	C10	C9	H12	117.3°	119.9°
C11	C10	C9	C4	110.6°	108.1°
C11	C10	C9	C8	69.3°	71.3°
C10	C11	H10	H11	118.4°	120.0°
C10	C9	C4	C8	179.9°	179.3°
C10	C9	C4	C5	179.9°	178.8°
C10	C9	C8	C7	179.7°	178.8°
C10	C9	C8	H2	0.3°	1.2°
C9	C10	C11	H10	81.7°	55.0°
C9	C10	C11	H11	37.3°	65.0°
C9	C4	C5	C6	0.2°	0.2°
C4	C9	C8	C7	0.2°	0.5°
C4	C9	C8	H2	179.8°	179.5°
C9	C4	C5	H4	179.9°	179.7°
C9	C4	C3	H6	138.2°	99.8°
C9	C4	C3	H7	102.6°	140.9°
C4	C9	C10	H12	132.1°	132.1°
C5	C4	C9	C8	0.0°	0.5°
C4	C5	C6	H4	180.0°	179.9°
C4	C5	C6	C7	0.2°	0.1°
C4	C5	C6	H5	179.8°	179.9°
C5	C4	C3	H6	42.1°	79.2°
C5	C4	C3	H7	77.1°	40.0°
C9	C8	C7	H2	180.0°	180.0°
C9	C8	C7	C6	0.2°	0.3°
C9	C8	C7	H1	179.8°	180.0°
C8	C9	C10	H12	47.9°	48.6°
C5	C6	C7	C8	0.0°	0.0°
C5	C6	C7	H5	180.0°	179.9°
C5	C6	C7	H1	180.0°	179.7°
C8	C7	C6	H1	180.0°	179.7°
C8	C7	C6	H5	180.0°	179.9°
C6	C7	C8	H2	179.8°	179.7°
C7	C6	C5	H4	179.8°	180.0°
H1	C7	C8	H2	0.2°	0.0°
H1	C7	C6	H5	0.0°	0.2°
H4	C5	C6	H5	0.1°	0.1°
H6	C3	C2	H8	47.2°	46.8°
H6	C3	C2	H9	72.8°	167.6°
H7	C3	C2	H8	166.4°	72.5°
H7	C3	C2	H9	46.4°	48.2°
H10	C11	C10	H12	35.7°	65.0°
H11	C11	C10	H12	154.7°	175.1°
H13	C	H14	H15	120.0°	120.0°

Release date:	2022-11-02
Definition date:	2022-09-02
Last modified:	2022-10-28
Release status:	REL
Processing site:	RCSB
Derived from:	5STQ