ZP5

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1	C1	doub	1.22Å	1.23Å
C1	N1	sing	1.35Å	1.36Å
N1	C2	sing	1.39Å	1.40Å
C2	C3	sing	1.42Å	1.40Å	Aromatic
C3	C4	doub	1.35Å	1.34Å	Aromatic
C4	O2	sing	1.34Å	1.34Å	Aromatic
O2	N2	sing	1.21Å	1.42Å	Aromatic
C1	N3	sing	1.35Å	1.36Å
N3	C5	sing	1.47Å	1.46Å
C5	C6	sing	1.53Å	1.52Å
C6	N4	sing	1.47Å	1.47Å
N4	C7	sing	1.47Å	1.46Å
C7	C8	sing	1.53Å	1.51Å
N4	C9	sing	1.35Å	1.34Å
C9	O3	doub	1.22Å	1.23Å
C9	C10	sing	1.47Å	1.45Å
C10	C11	doub	1.37Å	1.36Å	Aromatic
C11	C12	sing	1.40Å	1.42Å	Aromatic
C12	C13	doub	1.35Å	1.37Å	Aromatic
C13	O4	sing	1.34Å	1.36Å	Aromatic
C2	N2	doub	1.31Å	1.30Å	Aromatic
N3	C8	sing	1.47Å	1.46Å
C10	O4	sing	1.35Å	1.37Å	Aromatic
N1	H1	sing	0.97Å	1.00Å
C4	H3	sing	1.08Å	1.08Å
C5	H5	sing	1.09Å	1.10Å
C5	H4	sing	1.09Å	1.10Å
C6	H7	sing	1.09Å	1.10Å
C6	H6	sing	1.09Å	1.10Å
C7	H8	sing	1.09Å	1.10Å
C7	H9	sing	1.09Å	1.10Å
C8	H11	sing	1.09Å	1.10Å
C8	H10	sing	1.09Å	1.10Å
C13	H14	sing	1.08Å	1.08Å
C11	H12	sing	1.08Å	1.08Å
C12	H13	sing	1.08Å	1.08Å
C3	H2	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	N1	122.2°	120.0°
O1	C1	N3	121.2°	120.0°
C1	N1	C2	127.0°	120.0°
N1	C1	N3	116.6°	119.9°
C1	N1	H1	116.5°	120.1°
N1	C2	C3	128.2°	126.9°
N1	C2	N2	121.5°	126.9°
C2	N1	H1	116.5°	120.0°
C2	C3	C4	107.3°	103.9°
C3	C2	N2	110.3°	106.2°
C2	C3	H2	126.3°	128.0°
C3	C4	O2	107.9°	106.6°
C3	C4	H3	126.1°	126.7°
C4	C3	H2	126.4°	128.0°
C4	O2	N2	109.0°	111.8°
O2	C4	H3	126.1°	126.8°
O2	N2	C2	105.5°	111.5°
C1	N3	C5	121.4°	120.6°
C1	N3	C8	125.7°	120.6°
N3	C5	C6	111.2°	108.7°
C5	N3	C8	112.9°	118.8°
N3	C5	H5	109.0°	109.6°
N3	C5	H4	109.0°	109.6°
C5	C6	N4	109.4°	108.6°
C6	C5	H5	109.1°	109.6°
C6	C5	H4	109.1°	109.6°
C5	C6	H7	109.5°	109.6°
C5	C6	H6	109.5°	109.6°
C6	N4	C7	111.7°	118.8°
C6	N4	C9	126.8°	120.6°
N4	C6	H7	109.5°	109.6°
N4	C6	H6	109.5°	109.6°
N4	C7	C8	109.2°	108.6°
C7	N4	C9	121.4°	120.6°
N4	C7	H8	109.5°	109.6°
N4	C7	H9	109.5°	109.7°
C7	C8	N3	110.9°	108.7°
C8	C7	H8	109.5°	109.7°
C8	C7	H9	109.5°	109.6°
C7	C8	H11	109.1°	109.6°
C7	C8	H10	109.1°	109.6°
N4	C9	O3	118.9°	120.0°
N4	C9	C10	123.9°	120.0°
O3	C9	C10	117.0°	120.0°
C9	C10	C11	131.0°	126.0°
C9	C10	O4	119.0°	126.0°
C10	C11	C12	107.0°	106.7°
C11	C10	O4	110.0°	108.1°
C10	C11	H12	126.5°	126.7°
C11	C12	C13	106.2°	107.1°
C12	C11	H12	126.5°	126.7°
C11	C12	H13	126.9°	126.4°
C12	C13	O4	109.8°	108.8°
C12	C13	H14	125.1°	125.6°
C13	C12	H13	126.9°	126.4°
C13	O4	C10	107.0°	109.3°
O4	C13	H14	125.1°	125.6°
N3	C8	H11	109.1°	109.6°
N3	C8	H10	109.1°	109.6°
H5	C5	H4	109.5°	109.7°
H7	C6	H6	109.4°	109.8°
H8	C7	H9	109.4°	109.5°
H11	C8	H10	109.5°	109.7°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	N1	N3	179.4°	179.9°
O1	C1	N1	C2	3.8°	6.3°
O1	C1	N3	C5	3.5°	172.6°
O1	C1	N3	C8	177.8°	7.0°
O1	C1	N1	H1	176.3°	173.4°
C1	N1	C2	H1	180.0°	179.7°
C1	N1	C2	C3	5.8°	0.3°
N1	C1	N3	C5	175.9°	7.3°
C1	N1	C2	N2	174.9°	179.4°
N1	C1	N3	C8	2.8°	173.0°
N1	C2	C3	N2	179.3°	179.8°
N1	C2	C3	C4	179.6°	180.0°
N1	C2	N2	O2	179.6°	179.8°
C2	N1	C1	N3	175.6°	173.8°
N1	C2	C3	H2	0.4°	0.0°
C2	C3	C4	H2	180.0°	179.9°
C2	C3	C4	O2	0.2°	0.1°
C3	C2	N2	O2	0.2°	0.4°
C3	C2	N1	H1	174.2°	180.0°
C2	C3	C4	H3	179.8°	179.7°
C3	C4	O2	H3	180.0°	179.6°
C3	C4	O2	N2	0.1°	0.4°
C4	C3	C2	N2	0.3°	0.2°
C4	O2	N2	C2	0.0°	0.5°
O2	C4	C3	H2	179.8°	180.0°
N2	O2	C4	H3	179.9°	180.0°
C1	N3	C5	C8	178.9°	179.7°
C1	N3	C5	C6	127.4°	124.5°
C1	N3	C8	C7	126.9°	124.5°
N3	C1	N1	H1	4.4°	6.5°
C1	N3	C5	H5	7.2°	115.7°
C1	N3	C5	H4	112.3°	4.8°
C1	N3	C8	H11	6.7°	4.8°
C1	N3	C8	H10	112.9°	115.8°
N3	C5	C6	H5	120.3°	119.8°
N3	C5	C6	H4	120.3°	119.8°
N3	C5	C6	N4	54.8°	49.4°
C5	N3	C8	C7	54.3°	55.2°
N3	C5	H5	H4	119.2°	120.4°
N3	C5	C6	H7	65.2°	169.2°
N3	C5	C6	H6	174.8°	70.3°
C5	N3	C8	H11	174.5°	174.9°
C5	N3	C8	H10	65.9°	64.6°
C5	C6	N4	H7	120.0°	119.8°
C5	C6	N4	H6	120.0°	119.7°
C5	C6	N4	C7	59.1°	55.2°
C5	C6	N4	C9	117.6°	124.8°
C6	C5	N3	C8	53.7°	55.2°
C6	C5	H5	H4	119.2°	120.4°
C5	C6	H7	H6	120.0°	120.5°
C6	N4	C7	C9	176.9°	179.9°
C6	N4	C7	C8	59.7°	55.2°
C6	N4	C9	O3	156.2°	7.3°
C6	N4	C9	C10	27.9°	172.7°
N4	C6	C5	H5	175.1°	70.4°
N4	C6	C5	H4	65.4°	169.1°
N4	C6	H7	H6	120.0°	120.4°
C6	N4	C7	H8	60.2°	64.6°
C6	N4	C7	H9	179.7°	175.0°
N4	C7	C8	H8	120.0°	119.8°
N4	C7	C8	H9	120.0°	119.9°
C7	N4	C9	O3	27.3°	172.6°
C7	N4	C9	C10	148.5°	7.3°
N4	C7	C8	N3	56.1°	49.4°
C7	N4	C6	H7	60.9°	174.9°
C7	N4	C6	H6	179.1°	64.6°
N4	C7	H8	H9	120.1°	120.4°
N4	C7	C8	H11	176.3°	169.2°
N4	C7	C8	H10	64.2°	70.4°
C8	C7	N4	C9	117.2°	124.8°
C7	C8	N3	H11	120.2°	119.7°
C7	C8	N3	H10	120.2°	119.8°
C8	C7	H8	H9	120.1°	120.4°
C7	C8	H11	H10	119.3°	120.4°
N4	C9	O3	C10	176.2°	179.9°
N4	C9	C10	C11	171.5°	173.3°
N4	C9	C10	O4	10.4°	6.4°
C9	N4	C6	H7	122.4°	5.0°
C9	N4	C6	H6	2.4°	115.5°
C9	N4	C7	H8	122.8°	115.4°
C9	N4	C7	H9	2.8°	4.9°
O3	C9	C10	C11	12.5°	6.6°
O3	C9	C10	O4	165.5°	173.7°
C9	C10	C11	O4	178.2°	179.7°
C9	C10	C11	C12	178.4°	179.7°
C9	C10	O4	C13	179.0°	179.8°
C9	C10	C11	H12	1.6°	0.3°
C10	C11	C12	H12	180.0°	180.0°
C10	C11	C12	C13	0.2°	0.0°
C11	C10	O4	C13	0.5°	0.0°
C10	C11	C12	H13	179.8°	179.9°
C11	C12	C13	H13	180.0°	179.9°
C11	C12	C13	O4	0.5°	0.0°
C12	C11	C10	O4	0.2°	0.0°
C11	C12	C13	H14	179.5°	180.0°
C12	C13	O4	H14	180.0°	180.0°
C12	C13	O4	C10	0.6°	0.0°
C13	C12	C11	H12	179.8°	179.9°
O4	C13	C12	H13	179.5°	180.0°
N2	C2	N1	H1	5.1°	0.3°
N2	C2	C3	H2	179.7°	179.8°
C8	N3	C5	H5	173.9°	64.6°
C8	N3	C5	H4	66.6°	174.9°
N3	C8	C7	H8	63.9°	70.4°
N3	C8	C7	H9	176.0°	169.3°
N3	C8	H11	H10	119.4°	120.4°
C10	O4	C13	H14	179.4°	180.0°
O4	C10	C11	H12	179.8°	180.0°
H3	C4	C3	H2	0.2°	0.3°
H5	C5	C6	H7	55.1°	49.4°
H5	C5	C6	H6	64.9°	169.9°
H4	C5	C6	H7	174.6°	71.1°
H4	C5	C6	H6	54.6°	49.5°
H8	C7	C8	H11	56.3°	49.4°
H8	C7	C8	H10	175.9°	169.8°
H9	C7	C8	H11	63.7°	70.9°
H9	C7	C8	H10	55.8°	49.5°
H14	C13	C12	H13	0.5°	0.1°
H12	C11	C12	H13	0.2°	0.0°

Release date:	2023-03-29
Definition date:	2023-03-17
Last modified:	2023-03-24
Release status:	REL
Processing site:	RCSB
Derived from:	7FVM