A1CV7

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	N1	sing	1.47Å	1.49Å
N1	C2	sing	1.47Å	1.49Å
C2	C3	sing	1.53Å	1.51Å
C3	N2	sing	1.47Å	1.48Å
N2	C4	sing	1.47Å	1.48Å
C4	C5	sing	1.53Å	1.51Å
N1	C5	sing	1.47Å	1.49Å
N2	C6	sing	1.38Å	1.34Å
C6	C7	doub	1.36Å	1.39Å	Aromatic
C7	C8	sing	1.37Å	1.44Å	Aromatic
C8	C9	doub	1.37Å	1.43Å	Aromatic
C9	S1	sing	1.76Å	1.74Å	Aromatic
C6	S1	sing	1.71Å	1.73Å	Aromatic
C9	C10	sing	1.40Å	1.39Å
C10	C11	sing	1.51Å	1.50Å
C10	O1	doub	1.22Å	1.22Å
C11	H15	sing	1.09Å	1.10Å
C11	H16	sing	1.09Å	1.10Å
C11	H17	sing	1.09Å	1.10Å
C2	H5	sing	1.09Å	1.10Å
C2	H6	sing	1.09Å	1.10Å
C1	H1	sing	1.09Å	1.10Å
C1	H2	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C3	H7	sing	1.09Å	1.10Å
C3	H8	sing	1.09Å	1.10Å
C4	H10	sing	1.09Å	1.10Å
C4	H9	sing	1.09Å	1.10Å
C5	H11	sing	1.09Å	1.10Å
C5	H12	sing	1.09Å	1.10Å
C7	H13	sing	1.08Å	1.08Å
C8	H14	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C1	N1	C2	112.1°	111.0°
C1	N1	C5	111.7°	111.0°
N1	C1	H1	109.5°	109.4°
N1	C1	H2	109.5°	109.5°
N1	C1	H3	109.5°	109.5°
N1	C2	C3	110.8°	109.3°
C2	N1	C5	108.5°	110.9°
N1	C2	H5	109.2°	109.5°
N1	C2	H6	109.2°	109.5°
C2	C3	N2	112.3°	109.4°
C3	C2	H5	109.1°	109.5°
C3	C2	H6	109.1°	109.5°
C2	C3	H7	108.7°	109.5°
C2	C3	H8	108.8°	109.5°
C3	N2	C4	115.4°	110.9°
C3	N2	C6	123.5°	111.0°
N2	C3	H7	108.7°	109.5°
N2	C3	H8	108.7°	109.5°
N2	C4	C5	112.6°	109.4°
C4	N2	C6	120.6°	111.0°
N2	C4	H10	108.7°	109.5°
N2	C4	H9	108.7°	109.5°
C4	C5	N1	109.9°	109.4°
C5	C4	H10	108.7°	109.5°
C5	C4	H9	108.7°	109.5°
C4	C5	H11	109.4°	109.5°
C4	C5	H12	109.4°	109.5°
N1	C5	H11	109.4°	109.5°
N1	C5	H12	109.4°	109.5°
N2	C6	C7	127.9°	124.7°
N2	C6	S1	123.0°	124.6°
C6	C7	C8	115.6°	114.8°
C7	C6	S1	109.1°	110.7°
C6	C7	H13	122.2°	122.6°
C7	C8	C9	110.5°	113.4°
C8	C7	H13	122.2°	122.6°
C7	C8	H14	124.8°	123.3°
C8	C9	S1	110.3°	109.4°
C8	C9	C10	130.5°	125.3°
C9	C8	H14	124.7°	123.3°
C9	S1	C6	94.3°	91.7°
S1	C9	C10	119.2°	125.3°
C9	C10	C11	122.0°	120.0°
C9	C10	O1	117.6°	120.1°
C11	C10	O1	120.4°	120.0°
C10	C11	H15	109.5°	109.5°
C10	C11	H16	109.5°	109.4°
C10	C11	H17	109.5°	109.5°
H15	C11	H16	109.4°	109.5°
H15	C11	H17	109.5°	109.5°
H16	C11	H17	109.5°	109.5°
H5	C2	H6	109.4°	109.5°
H1	C1	H2	109.5°	109.4°
H1	C1	H3	109.5°	109.5°
H2	C1	H3	109.5°	109.5°
H7	C3	H8	109.5°	109.5°
H10	C4	H9	109.5°	109.5°
H11	C5	H12	109.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C1	N1	C2	C5	123.7°	123.8°
C1	N1	C2	C3	174.5°	176.8°
C1	N1	C5	C4	173.7°	176.8°
C1	N1	C2	H5	54.3°	63.2°
C1	N1	C2	H6	65.3°	56.9°
N1	C1	H1	H2	120.0°	120.0°
N1	C1	H1	H3	120.0°	120.0°
N1	C1	H2	H3	120.0°	120.0°
C1	N1	C5	H11	53.6°	56.8°
C1	N1	C5	H12	66.2°	63.2°
N1	C2	C3	H5	120.2°	120.0°
N1	C2	C3	H6	120.2°	120.0°
N1	C2	C3	N2	52.5°	58.5°
C2	N1	C5	C4	62.3°	59.3°
N1	C2	H5	H6	119.4°	120.1°
C2	N1	C1	H1	180.0°	60.1°
C2	N1	C1	H2	60.0°	180.0°
C2	N1	C1	H3	60.0°	60.0°
N1	C2	C3	H7	67.9°	61.6°
N1	C2	C3	H8	172.9°	178.4°
C2	N1	C5	H11	177.6°	179.3°
C2	N1	C5	H12	57.8°	60.6°
C2	C3	N2	H7	120.4°	120.0°
C2	C3	N2	H8	120.4°	119.9°
C2	C3	N2	C4	44.6°	59.4°
C3	C2	N1	C5	61.7°	59.3°
C2	C3	N2	C6	143.4°	176.8°
C3	C2	H5	H6	119.4°	120.0°
C2	C3	H7	H8	118.7°	120.0°
C3	N2	C4	C6	172.3°	123.9°
C3	N2	C4	C5	45.7°	59.3°
C3	N2	C6	C7	51.8°	180.0°
C3	N2	C6	S1	126.0°	0.3°
N2	C3	C2	H5	172.7°	61.5°
N2	C3	C2	H6	67.8°	178.4°
N2	C3	H7	H8	118.7°	120.1°
C3	N2	C4	H10	74.8°	179.3°
C3	N2	C4	H9	166.2°	60.6°
N2	C4	C5	H10	120.4°	120.0°
N2	C4	C5	H9	120.5°	120.0°
N2	C4	C5	N1	54.2°	58.4°
C4	N2	C6	C7	119.8°	56.2°
C4	N2	C6	S1	62.4°	124.1°
C4	N2	C3	H7	75.8°	60.6°
C4	N2	C3	H8	165.0°	179.3°
N2	C4	H10	H9	118.6°	120.1°
N2	C4	C5	H11	174.3°	178.4°
N2	C4	C5	H12	65.9°	61.6°
C4	C5	N1	H11	120.1°	120.0°
C4	C5	N1	H12	120.1°	119.9°
C5	C4	N2	C6	142.0°	176.8°
C5	C4	H10	H9	118.6°	120.0°
C4	C5	H11	H12	119.8°	120.0°
C5	N1	C2	H5	178.1°	60.6°
C5	N1	C2	H6	58.5°	179.3°
C5	N1	C1	H1	58.1°	176.1°
C5	N1	C1	H2	61.9°	56.2°
C5	N1	C1	H3	178.1°	63.8°
N1	C5	C4	H10	66.2°	178.3°
N1	C5	C4	H9	174.7°	61.6°
N1	C5	H11	H12	119.8°	120.1°
N2	C6	C7	S1	178.0°	179.7°
N2	C6	C7	C8	179.5°	179.8°
N2	C6	S1	C9	178.4°	179.8°
C6	N2	C3	H7	96.2°	63.2°
C6	N2	C3	H8	22.9°	56.9°
C6	N2	C4	H10	97.5°	56.9°
C6	N2	C4	H9	21.5°	63.3°
N2	C6	C7	H13	0.5°	0.3°
C6	C7	C8	H13	180.0°	179.9°
C6	C7	C8	C9	0.1°	0.0°
C7	C6	S1	C9	3.4°	0.0°
C6	C7	C8	H14	180.0°	180.0°
C7	C8	C9	H14	180.0°	179.9°
C7	C8	C9	S1	2.6°	0.0°
C8	C7	C6	S1	2.5°	0.0°
C7	C8	C9	C10	179.7°	179.9°
C8	C9	S1	C10	178.0°	180.0°
C8	C9	S1	C6	3.5°	0.0°
C8	C9	C10	C11	11.2°	180.0°
C8	C9	C10	O1	169.5°	0.0°
C9	C8	C7	H13	179.9°	180.0°
S1	C9	C10	C11	171.3°	0.0°
S1	C9	C10	O1	8.0°	180.0°
S1	C9	C8	H14	177.4°	180.0°
C6	S1	C9	C10	178.5°	180.0°
S1	C6	C7	H13	177.5°	180.0°
C9	C10	C11	O1	179.3°	180.0°
C9	C10	C11	H15	179.3°	180.0°
C9	C10	C11	H16	59.3°	60.0°
C9	C10	C11	H17	60.7°	60.0°
C10	C9	C8	H14	0.3°	0.0°
C10	C11	H15	H16	120.0°	120.0°
C10	C11	H15	H17	120.0°	120.0°
C10	C11	H16	H17	120.0°	120.0°
O1	C10	C11	H15	0.0°	0.0°
O1	C10	C11	H16	120.0°	120.0°
O1	C10	C11	H17	120.0°	120.0°
H15	C11	H16	H17	120.0°	120.1°
H5	C2	C3	H7	52.3°	178.4°
H5	C2	C3	H8	66.9°	58.4°
H6	C2	C3	H7	171.8°	58.4°
H6	C2	C3	H8	52.6°	61.6°
H1	C1	H2	H3	120.0°	120.0°
H10	C4	C5	H11	53.9°	61.7°
H10	C4	C5	H12	173.7°	58.4°
H9	C4	C5	H11	65.2°	58.4°
H9	C4	C5	H12	54.6°	178.5°
H13	C7	C8	H14	0.1°	0.1°

Release date:	2026-02-18
Definition date:	2025-09-26
Last modified:	2026-02-13
Release status:	REL
Processing site:	RCSB
Derived from:	13PO