A1AXC

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	1.35Å
C1	C6	sing	1.48Å	1.50Å
N1	C2	sing	1.47Å	1.46Å
N1	C5	sing	1.47Å	1.47Å
C2	C3	sing	1.53Å	1.51Å
C3	O2	sing	1.43Å	1.42Å
O2	C4	sing	1.43Å	1.42Å
C4	C5	sing	1.53Å	1.51Å
C6	C7	doub	1.40Å	1.39Å	Aromatic
C6	C11	sing	1.40Å	1.39Å	Aromatic
C7	C8	sing	1.38Å	1.39Å	Aromatic
C8	C9	doub	1.38Å	1.38Å	Aromatic
C9	C10	sing	1.38Å	1.38Å	Aromatic
C10	C11	doub	1.38Å	1.39Å	Aromatic
C4	H43	sing	1.09Å	1.10Å
C4	H42	sing	1.09Å	1.10Å
C11	H11	sing	1.08Å	1.08Å
C8	H8	sing	1.08Å	1.08Å
C9	H9	sing	1.08Å	1.08Å
C10	H10	sing	1.08Å	1.08Å
C3	H32	sing	1.09Å	1.10Å
C3	H33	sing	1.09Å	1.10Å
C2	H23	sing	1.09Å	1.10Å
C2	H22	sing	1.09Å	1.10Å
C5	H53	sing	1.09Å	1.10Å
C5	H52	sing	1.09Å	1.10Å
C7	H7	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C1	N1	121.4°	120.0°
O1	C1	C6	118.4°	120.0°
N1	C1	C6	120.0°	120.0°
C1	N1	C2	121.2°	121.0°
C1	N1	C5	124.8°	121.0°
C1	C6	C7	117.7°	120.1°
C1	C6	C11	122.7°	120.2°
C2	N1	C5	113.8°	118.0°
N1	C2	C3	109.9°	108.4°
N1	C2	H23	109.4°	109.7°
N1	C2	H22	109.4°	109.7°
N1	C5	C4	110.3°	108.4°
N1	C5	H53	109.2°	109.7°
N1	C5	H52	109.3°	109.7°
C2	C3	O2	110.7°	109.2°
C2	C3	H32	109.1°	109.5°
C2	C3	H33	109.2°	109.6°
C3	C2	H23	109.4°	109.6°
C3	C2	H22	109.3°	109.7°
C3	O2	C4	109.4°	114.2°
O2	C3	H32	109.1°	109.5°
O2	C3	H33	109.2°	109.5°
O2	C4	C5	112.2°	109.2°
O2	C4	H43	108.8°	109.5°
O2	C4	H42	108.8°	109.6°
C5	C4	H43	108.8°	109.5°
C5	C4	H42	108.8°	109.6°
C4	C5	H53	109.3°	109.7°
C4	C5	H52	109.3°	109.7°
C7	C6	C11	119.5°	119.7°
C6	C7	C8	120.4°	119.8°
C6	C7	H7	119.8°	120.0°
C6	C11	C10	119.8°	119.9°
C6	C11	H11	120.1°	120.1°
C7	C8	C9	119.7°	120.2°
C7	C8	H8	120.1°	119.9°
C8	C7	H7	119.8°	120.1°
C8	C9	C10	120.2°	120.3°
C9	C8	H8	120.1°	119.9°
C8	C9	H9	119.9°	119.9°
C9	C10	C11	120.4°	120.2°
C10	C9	H9	119.9°	119.8°
C9	C10	H10	119.8°	120.0°
C10	C11	H11	120.1°	120.1°
C11	C10	H10	119.8°	119.9°
H43	C4	H42	109.5°	109.5°
H32	C3	H33	109.5°	109.6°
H23	C2	H22	109.5°	109.7°
H53	C5	H52	109.5°	109.7°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C1	N1	C6	176.2°	180.0°
O1	C1	N1	C2	79.6°	3.8°
O1	C1	N1	C5	94.4°	176.2°
O1	C1	C6	C7	3.1°	48.4°
O1	C1	C6	C11	178.2°	131.3°
C1	N1	C2	C5	174.6°	180.0°
C1	N1	C2	C3	134.5°	129.4°
C1	N1	C5	C4	137.2°	129.5°
N1	C1	C6	C7	173.2°	131.6°
N1	C1	C6	C11	5.5°	48.7°
C1	N1	C2	H23	14.4°	9.8°
C1	N1	C2	H22	105.5°	110.8°
C1	N1	C5	H53	102.7°	110.8°
C1	N1	C5	H52	17.0°	9.7°
C6	C1	N1	C2	104.2°	176.2°
C6	C1	N1	C5	81.8°	3.8°
C1	C6	C7	C11	178.7°	179.7°
C1	C6	C7	C8	178.8°	179.7°
C1	C6	C11	C10	178.9°	179.8°
C1	C6	C11	H11	1.1°	0.3°
C1	C6	C7	H7	1.2°	0.3°
N1	C2	C3	H23	120.1°	119.7°
N1	C2	C3	H22	120.0°	119.8°
N1	C2	C3	O2	57.5°	52.3°
C2	N1	C5	C4	48.5°	50.5°
N1	C2	C3	H32	62.7°	172.2°
N1	C2	C3	H33	177.7°	67.6°
N1	C2	H23	H22	119.8°	120.6°
C2	N1	C5	H53	71.6°	69.2°
C2	N1	C5	H52	168.6°	170.3°
C5	N1	C2	C3	50.9°	50.6°
N1	C5	C4	O2	52.9°	52.2°
N1	C5	C4	H53	120.1°	119.7°
N1	C5	C4	H52	120.1°	119.7°
N1	C5	C4	H43	67.5°	67.6°
N1	C5	C4	H42	173.3°	172.3°
C5	N1	C2	H23	171.0°	170.2°
C5	N1	C2	H22	69.1°	69.2°
N1	C5	H53	H52	119.6°	120.5°
C2	C3	O2	H32	120.2°	119.9°
C2	C3	O2	H33	120.2°	119.9°
C2	C3	O2	C4	62.6°	62.6°
C2	C3	H32	H33	119.4°	120.2°
C3	C2	H23	H22	119.8°	120.5°
C3	O2	C4	C5	60.6°	62.6°
C3	O2	C4	H43	59.9°	57.3°
C3	O2	C4	H42	179.0°	177.4°
O2	C3	H32	H33	119.4°	120.1°
O2	C3	C2	H23	177.6°	172.0°
O2	C3	C2	H22	62.5°	67.5°
O2	C4	C5	H43	120.4°	119.9°
O2	C4	C5	H42	120.4°	120.1°
O2	C4	H43	H42	118.8°	120.2°
C4	O2	C3	H32	57.6°	177.5°
C4	O2	C3	H33	177.2°	57.4°
O2	C4	C5	H53	67.2°	67.4°
O2	C4	C5	H52	173.0°	172.0°
C5	C4	H43	H42	118.7°	120.1°
C4	C5	H53	H52	119.6°	120.5°
C6	C7	C8	H7	180.0°	180.0°
C6	C7	C8	C9	0.5°	0.0°
C7	C6	C11	C10	0.2°	0.1°
C7	C6	C11	H11	179.7°	180.0°
C6	C7	C8	H8	179.5°	180.0°
C11	C6	C7	C8	0.1°	0.0°
C6	C11	C10	C9	0.2°	0.1°
C6	C11	C10	H11	180.0°	179.9°
C6	C11	C10	H10	179.8°	180.0°
C11	C6	C7	H7	179.9°	180.0°
C7	C8	C9	H8	180.0°	180.0°
C7	C8	C9	C10	0.9°	0.0°
C7	C8	C9	H9	179.1°	180.0°
C8	C9	C10	H9	180.0°	180.0°
C8	C9	C10	C11	0.8°	0.1°
C8	C9	C10	H10	179.2°	180.0°
C9	C8	C7	H7	179.5°	180.0°
C9	C10	C11	H10	180.0°	179.9°
C9	C10	C11	H11	179.8°	180.0°
C10	C9	C8	H8	179.1°	180.0°
C11	C10	C9	H9	179.2°	179.9°
H43	C4	C5	H53	172.4°	172.7°
H43	C4	C5	H52	52.6°	52.1°
H42	C4	C5	H53	53.2°	52.6°
H42	C4	C5	H52	66.6°	67.9°
H11	C11	C10	H10	0.2°	0.1°
H8	C8	C9	H9	1.0°	0.1°
H8	C8	C7	H7	0.5°	0.0°
H9	C9	C10	H10	0.8°	0.0°
H32	C3	C2	H23	57.4°	68.1°
H32	C3	C2	H22	177.3°	52.4°
H33	C3	C2	H23	62.2°	52.1°
H33	C3	C2	H22	57.7°	172.6°

Release date:	2025-03-26
Definition date:	2024-07-10
Last modified:	2025-03-21
Release status:	REL
Processing site:	RCSB
Derived from:	7HAB