A1A35

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C	N	sing	1.46Å	1.47Å
C1	N	sing	1.46Å	1.44Å
N	C2	sing	1.35Å	1.34Å
O	C2	doub	1.22Å	1.22Å
C2	N1	sing	1.35Å	1.34Å
N1	C3	sing	1.47Å	1.46Å
C3	C4	sing	1.53Å	1.50Å
C4	N2	sing	1.47Å	1.47Å
C5	N2	sing	1.47Å	1.47Å
C6	C5	sing	1.53Å	1.51Å
N1	C6	sing	1.47Å	1.47Å
N2	C7	sing	1.35Å	1.36Å
C7	O1	doub	1.22Å	1.22Å
N3	C7	sing	1.35Å	1.36Å
C8	N3	sing	1.47Å	1.47Å
C9	N3	sing	1.47Å	1.46Å
C4	H8	sing	1.09Å	1.10Å
C4	H9	sing	1.09Å	1.10Å
C5	H10	sing	1.09Å	1.10Å
C5	H11	sing	1.09Å	1.10Å
C6	H12	sing	1.09Å	1.10Å
C6	H13	sing	1.09Å	1.10Å
C8	H14	sing	1.09Å	1.10Å
C8	H16	sing	1.09Å	1.10Å
C8	H15	sing	1.09Å	1.10Å
C9	H17	sing	1.09Å	1.10Å
C9	H18	sing	1.09Å	1.10Å
C9	H19	sing	1.09Å	1.10Å
C3	H6	sing	1.09Å	1.10Å
C3	H7	sing	1.09Å	1.10Å
C1	H4	sing	1.09Å	1.10Å
C1	H5	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C	H1	sing	1.09Å	1.10Å
C	H	sing	1.09Å	1.10Å
C	H2	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C	N	C1	115.9°	120.0°
C	N	C2	126.6°	120.0°
N	C	H1	109.5°	109.5°
N	C	H	109.5°	109.5°
N	C	H2	109.5°	109.5°
C1	N	C2	117.4°	120.0°
N	C1	H4	109.5°	109.5°
N	C1	H5	109.4°	109.5°
N	C1	H3	109.5°	109.4°
N	C2	O	121.1°	120.0°
N	C2	N1	116.0°	120.0°
O	C2	N1	122.9°	120.0°
C2	N1	C3	117.2°	120.6°
C2	N1	C6	118.9°	120.6°
N1	C3	C4	109.9°	108.6°
C3	N1	C6	113.3°	118.8°
N1	C3	H6	109.4°	109.7°
N1	C3	H7	109.4°	109.6°
C3	C4	N2	110.0°	108.6°
C3	C4	H8	109.3°	109.7°
C3	C4	H9	109.3°	109.8°
C4	C3	H6	109.4°	109.6°
C4	C3	H7	109.4°	109.6°
C4	N2	C5	113.1°	118.8°
C4	N2	C7	119.8°	120.7°
N2	C4	H8	109.3°	109.6°
N2	C4	H9	109.3°	109.5°
N2	C5	C6	110.0°	108.6°
C5	N2	C7	122.4°	120.5°
N2	C5	H10	109.3°	109.6°
N2	C5	H11	109.4°	109.6°
C5	C6	N1	110.2°	108.6°
C6	C5	H10	109.3°	109.6°
C6	C5	H11	109.3°	109.8°
C5	C6	H12	109.3°	109.6°
C5	C6	H13	109.3°	109.6°
N1	C6	H12	109.3°	109.7°
N1	C6	H13	109.3°	109.6°
N2	C7	O1	122.2°	120.0°
N2	C7	N3	115.5°	120.0°
O1	C7	N3	122.3°	120.0°
C7	N3	C8	124.1°	120.0°
C7	N3	C9	120.4°	120.0°
C8	N3	C9	115.5°	120.0°
N3	C8	H14	109.5°	109.5°
N3	C8	H16	109.5°	109.5°
N3	C8	H15	109.5°	109.5°
N3	C9	H17	109.5°	109.5°
N3	C9	H18	109.5°	109.5°
N3	C9	H19	109.5°	109.4°
H8	C4	H9	109.5°	109.7°
H10	C5	H11	109.5°	109.6°
H12	C6	H13	109.5°	109.7°
H14	C8	H16	109.5°	109.5°
H14	C8	H15	109.5°	109.5°
H16	C8	H15	109.5°	109.4°
H17	C9	H18	109.4°	109.5°
H17	C9	H19	109.5°	109.4°
H18	C9	H19	109.5°	109.5°
H6	C3	H7	109.4°	109.7°
H4	C1	H5	109.5°	109.5°
H4	C1	H3	109.5°	109.5°
H5	C1	H3	109.5°	109.5°
H1	C	H	109.5°	109.5°
H1	C	H2	109.4°	109.5°
H	C	H2	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C	N	C1	C2	175.9°	180.0°
C	N	C2	O	171.7°	87.4°
C	N	C2	N1	8.2°	92.6°
C	N	C1	H4	180.0°	90.0°
C	N	C1	H5	60.0°	30.0°
C	N	C1	H3	60.0°	150.0°
N	C	H1	H	120.0°	120.1°
N	C	H1	H2	120.0°	120.0°
N	C	H	H2	120.0°	120.0°
C1	N	C2	O	3.7°	92.6°
C1	N	C2	N1	176.4°	87.3°
N	C1	H4	H5	120.0°	120.0°
N	C1	H4	H3	120.0°	120.0°
N	C1	H5	H3	120.0°	120.0°
C1	N	C	H1	180.0°	54.4°
C1	N	C	H	60.0°	65.6°
C1	N	C	H2	60.0°	174.4°
N	C2	O	N1	179.8°	180.0°
N	C2	N1	C3	155.5°	169.3°
N	C2	N1	C6	62.1°	10.4°
C2	N	C1	H4	4.1°	90.0°
C2	N	C1	H5	115.9°	150.0°
C2	N	C1	H3	124.1°	30.1°
C2	N	C	H1	4.5°	125.6°
C2	N	C	H	124.5°	114.3°
C2	N	C	H2	115.5°	5.6°
O	C2	N1	C3	24.3°	10.7°
O	C2	N1	C6	118.0°	169.6°
C2	N1	C3	C6	144.4°	179.7°
C2	N1	C3	C4	127.1°	125.0°
C2	N1	C6	C5	173.3°	125.0°
C2	N1	C6	H12	53.2°	5.3°
C2	N1	C6	H13	66.6°	115.2°
C2	N1	C3	H6	112.8°	115.2°
C2	N1	C3	H7	7.0°	5.4°
N1	C3	C4	H6	120.1°	119.8°
N1	C3	C4	H7	120.1°	119.7°
N1	C3	C4	N2	63.7°	49.5°
C3	N1	C6	C5	42.9°	55.3°
N1	C3	C4	H8	176.3°	70.3°
N1	C3	C4	H9	56.4°	169.2°
C3	N1	C6	H12	163.1°	175.0°
C3	N1	C6	H13	77.2°	64.5°
N1	C3	H6	H7	119.8°	120.5°
C3	C4	N2	H8	120.1°	119.8°
C3	C4	N2	H9	120.1°	119.9°
C3	C4	N2	C5	45.0°	55.2°
C4	C3	N1	C6	17.3°	55.3°
C3	C4	N2	C7	158.6°	124.7°
C3	C4	H8	H9	119.8°	120.6°
C4	C3	H6	H7	119.8°	120.4°
C4	N2	C5	C7	155.7°	180.0°
C4	N2	C5	C6	15.4°	55.2°
C4	N2	C7	O1	78.9°	44.9°
C4	N2	C7	N3	102.1°	135.0°
N2	C4	H8	H9	119.7°	120.3°
C4	N2	C5	H10	104.7°	64.5°
C4	N2	C5	H11	135.5°	175.1°
N2	C4	C3	H6	56.4°	70.3°
N2	C4	C3	H7	176.2°	169.2°
N2	C5	C6	H10	120.1°	119.7°
N2	C5	C6	H11	120.1°	119.8°
N2	C5	C6	N1	61.4°	49.4°
C5	N2	C7	O1	75.2°	135.0°
C5	N2	C7	N3	103.8°	45.0°
C5	N2	C4	H8	165.1°	64.5°
C5	N2	C4	H9	75.1°	175.1°
N2	C5	H10	H11	119.8°	120.3°
N2	C5	C6	H12	178.5°	169.2°
N2	C5	C6	H13	58.7°	70.4°
C5	C6	N1	H12	120.1°	119.7°
C5	C6	N1	H13	120.1°	119.8°
C6	C5	N2	C7	140.3°	124.8°
C6	C5	H10	H11	119.7°	120.5°
C5	C6	H12	H13	119.7°	120.4°
N1	C6	C5	H10	58.7°	70.3°
N1	C6	C5	H11	178.5°	169.2°
N1	C6	H12	H13	119.7°	120.4°
C6	N1	C3	H6	102.8°	64.5°
C6	N1	C3	H7	137.3°	175.0°
N2	C7	O1	N3	179.0°	180.0°
N2	C7	N3	C8	68.4°	177.0°
N2	C7	N3	C9	111.8°	2.9°
C7	N2	C4	H8	38.6°	115.5°
C7	N2	C4	H9	81.3°	4.8°
C7	N2	C5	H10	99.6°	115.5°
C7	N2	C5	H11	20.2°	4.9°
O1	C7	N3	C8	112.6°	2.9°
O1	C7	N3	C9	67.2°	177.1°
C7	N3	C8	C9	179.7°	179.9°
C7	N3	C8	H14	180.0°	90.0°
C7	N3	C8	H16	60.0°	150.0°
C7	N3	C8	H15	60.0°	30.0°
C7	N3	C9	H17	180.0°	119.9°
C7	N3	C9	H18	60.0°	120.1°
C7	N3	C9	H19	60.0°	0.0°
N3	C8	H14	H16	120.0°	120.0°
N3	C8	H14	H15	120.0°	120.0°
N3	C8	H16	H15	120.0°	120.0°
C8	N3	C9	H17	0.2°	60.1°
C8	N3	C9	H18	119.8°	59.9°
C8	N3	C9	H19	120.3°	179.9°
C9	N3	C8	H14	0.2°	90.0°
C9	N3	C8	H16	120.2°	30.1°
C9	N3	C8	H15	119.7°	150.0°
N3	C9	H17	H18	120.0°	120.1°
N3	C9	H17	H19	120.0°	119.9°
N3	C9	H18	H19	120.0°	120.0°
H8	C4	C3	H6	63.7°	169.9°
H8	C4	C3	H7	56.2°	49.5°
H9	C4	C3	H6	176.4°	49.4°
H9	C4	C3	H7	63.7°	71.1°
H10	C5	C6	H12	61.4°	49.5°
H10	C5	C6	H13	178.8°	169.9°
H11	C5	C6	H12	58.4°	71.0°
H11	C5	C6	H13	61.4°	49.4°
H14	C8	H16	H15	120.0°	120.0°
H17	C9	H18	H19	120.0°	120.0°
H4	C1	H5	H3	120.0°	120.0°
H1	C	H	H2	119.9°	120.0°

Release date:	2024-11-06
Definition date:	2024-08-29
Last modified:	2024-11-01
Release status:	REL
Processing site:	RCSB
Derived from:	7HGI