A1DM0

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.51Å	1.47Å
C2	C3	doub	1.36Å	1.40Å	Aromatic
C2	N6	sing	1.36Å	1.39Å	Aromatic
C3	C4	sing	1.40Å	1.43Å	Aromatic
C3	N8	sing	1.41Å	1.42Å
C4	N5	doub	1.31Å	1.36Å	Aromatic
C4	C7	sing	1.51Å	1.47Å
N5	N6	sing	1.40Å	1.36Å	Aromatic
N8	C9	sing	1.47Å	1.49Å
N8	C13	sing	1.47Å	1.49Å
C9	C10	sing	1.53Å	1.53Å
C10	C11	sing	1.53Å	1.53Å
C11	C12	sing	1.53Å	1.53Å
C11	C14	sing	1.51Å	1.50Å
C12	C13	sing	1.53Å	1.53Å
C14	C15	doub	1.38Å	1.39Å	Aromatic
C14	C19	sing	1.39Å	1.41Å	Aromatic
C15	C16	sing	1.39Å	1.39Å	Aromatic
C16	C17	doub	1.38Å	1.39Å	Aromatic
C17	N18	sing	1.32Å	1.35Å	Aromatic
N18	C19	doub	1.32Å	1.36Å	Aromatic
C19	O20	sing	1.36Å	1.36Å
O20	C21	sing	1.43Å	1.41Å
C7	H7B	sing	1.09Å	1.10Å
C7	H7C	sing	1.09Å	1.10Å
C7	H7A	sing	1.09Å	1.10Å
C9	H9B	sing	1.09Å	1.10Å
C9	H9A	sing	1.09Å	1.10Å
C13	H13A	sing	1.09Å	1.10Å
C13	H13B	sing	1.09Å	1.10Å
C21	H21A	sing	1.09Å	1.10Å
C21	H21C	sing	1.09Å	1.10Å
C21	H21B	sing	1.09Å	1.10Å
C16	H16	sing	1.08Å	1.08Å
C1	H1C	sing	1.09Å	1.10Å
C1	H1B	sing	1.09Å	1.10Å
C1	H1A	sing	1.09Å	1.10Å
N6	H6	sing	0.97Å	1.00Å
C10	H10B	sing	1.09Å	1.10Å
C10	H10A	sing	1.09Å	1.10Å
C11	H11	sing	1.09Å	1.10Å
C12	H12A	sing	1.09Å	1.10Å
C12	H12B	sing	1.09Å	1.10Å
C15	H15	sing	1.08Å	1.08Å
C17	H17	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C1	C2	C3	132.0°	126.2°
C1	C2	N6	122.5°	126.3°
C2	C1	H1C	109.5°	109.5°
C2	C1	H1B	109.5°	109.4°
C2	C1	H1A	109.5°	109.5°
C3	C2	N6	105.5°	107.6°
C2	C3	C4	106.1°	107.8°
C2	C3	N8	132.3°	126.1°
C2	N6	N5	112.8°	107.8°
C2	N6	H6	123.6°	126.0°
C4	C3	N8	121.5°	126.1°
C3	C4	N5	110.1°	108.4°
C3	C4	C7	126.2°	125.8°
C3	N8	C9	111.8°	111.0°
C3	N8	C13	111.3°	111.0°
N5	C4	C7	123.7°	125.8°
C4	N5	N6	105.6°	108.4°
C4	C7	H7B	109.5°	109.5°
C4	C7	H7C	109.4°	109.5°
C4	C7	H7A	109.5°	109.5°
N5	N6	H6	123.6°	126.1°
C9	N8	C13	111.3°	111.2°
N8	C9	C10	108.2°	109.5°
N8	C9	H9B	109.8°	109.5°
N8	C9	H9A	109.8°	109.5°
N8	C13	C12	108.3°	109.5°
N8	C13	H13A	109.8°	109.5°
N8	C13	H13B	109.8°	109.5°
C9	C10	C11	110.7°	109.2°
C10	C9	H9B	109.8°	109.5°
C10	C9	H9A	109.8°	109.5°
C9	C10	H10B	109.1°	109.5°
C9	C10	H10A	109.1°	109.5°
C10	C11	C12	109.1°	109.2°
C10	C11	C14	110.8°	109.5°
C11	C10	H10B	109.1°	109.5°
C11	C10	H10A	109.2°	109.5°
C10	C11	H11	109.1°	109.5°
C12	C11	C14	109.2°	109.5°
C11	C12	C13	110.0°	109.3°
C12	C11	H11	109.1°	109.5°
C11	C12	H12A	109.3°	109.5°
C11	C12	H12B	109.3°	109.4°
C11	C14	C15	121.5°	120.4°
C11	C14	C19	122.0°	120.5°
C14	C11	H11	109.5°	109.6°
C12	C13	H13A	109.7°	109.4°
C12	C13	H13B	109.8°	109.5°
C13	C12	H12A	109.3°	109.6°
C13	C12	H12B	109.3°	109.5°
C15	C14	C19	116.4°	119.1°
C14	C15	C16	120.5°	118.5°
C14	C15	H15	119.7°	120.7°
C14	C19	N18	124.9°	120.6°
C14	C19	O20	116.5°	119.6°
C15	C16	C17	118.5°	119.3°
C15	C16	H16	120.8°	120.4°
C16	C15	H15	119.8°	120.8°
C16	C17	N18	123.6°	120.8°
C17	C16	H16	120.7°	120.3°
C16	C17	H17	118.2°	119.5°
C17	N18	C19	116.1°	121.7°
N18	C17	H17	118.2°	119.6°
N18	C19	O20	118.6°	119.7°
C19	O20	C21	117.1°	117.0°
O20	C21	H21A	109.5°	109.4°
O20	C21	H21C	109.5°	109.5°
O20	C21	H21B	109.5°	109.5°
H7B	C7	H7C	109.5°	109.5°
H7B	C7	H7A	109.5°	109.5°
H7C	C7	H7A	109.5°	109.4°
H9B	C9	H9A	109.5°	109.4°
H13A	C13	H13B	109.5°	109.4°
H21A	C21	H21C	109.5°	109.5°
H21A	C21	H21B	109.4°	109.5°
H21C	C21	H21B	109.5°	109.5°
H1C	C1	H1B	109.5°	109.5°
H1C	C1	H1A	109.5°	109.5°
H1B	C1	H1A	109.5°	109.5°
H10B	C10	H10A	109.5°	109.5°
H12A	C12	H12B	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C1	C2	C3	N6	179.3°	179.7°
C1	C2	C3	C4	179.8°	180.0°
C1	C2	C3	N8	0.7°	0.2°
C1	C2	N6	N5	179.8°	179.9°
C2	C1	H1C	H1B	120.0°	120.0°
C2	C1	H1C	H1A	120.0°	120.0°
C2	C1	H1B	H1A	120.0°	120.0°
C1	C2	N6	H6	0.2°	0.4°
C2	C3	C4	N8	179.2°	179.8°
C2	C3	C4	N5	0.4°	0.0°
C2	C3	C4	C7	179.1°	179.7°
C3	C2	N6	N5	0.4°	0.5°
C2	C3	N8	C9	50.4°	55.5°
C2	C3	N8	C13	74.7°	68.6°
C3	C2	C1	H1C	89.5°	84.5°
C3	C2	C1	H1B	150.5°	155.5°
C3	C2	C1	H1A	30.5°	35.5°
C3	C2	N6	H6	179.6°	180.0°
N6	C2	C3	C4	0.5°	0.3°
N6	C2	C3	N8	178.6°	179.9°
C2	N6	N5	C4	0.1°	0.5°
C2	N6	N5	H6	180.0°	179.5°
N6	C2	C1	H1C	89.6°	95.1°
N6	C2	C1	H1B	30.4°	24.9°
N6	C2	C1	H1A	150.4°	144.9°
C3	C4	N5	C7	179.5°	179.7°
C3	C4	N5	N6	0.2°	0.3°
C4	C3	N8	C9	128.6°	124.7°
C4	C3	N8	C13	106.3°	111.1°
C3	C4	C7	H7B	179.5°	94.4°
C3	C4	C7	H7C	60.5°	25.6°
C3	C4	C7	H7A	59.5°	145.6°
N8	C3	C4	N5	178.7°	179.8°
N8	C3	C4	C7	1.7°	0.1°
C3	N8	C9	C13	125.1°	124.0°
C3	N8	C9	C10	172.8°	174.2°
C3	N8	C13	C12	171.8°	174.2°
C3	N8	C9	H9B	53.0°	54.2°
C3	N8	C9	H9A	67.5°	65.7°
C3	N8	C13	H13A	68.4°	65.8°
C3	N8	C13	H13B	52.0°	54.1°
N5	C4	C7	H7B	0.0°	86.0°
N5	C4	C7	H7C	120.0°	154.0°
N5	C4	C7	H7A	120.0°	34.0°
C4	N5	N6	H6	179.8°	180.0°
C7	C4	N5	N6	179.3°	180.0°
C4	C7	H7B	H7C	120.0°	120.0°
C4	C7	H7B	H7A	120.0°	120.0°
C4	C7	H7C	H7A	120.0°	120.0°
N8	C9	C10	H9B	119.8°	120.0°
N8	C9	C10	H9A	119.8°	120.1°
N8	C9	C10	C11	58.9°	59.2°
C9	N8	C13	C12	62.8°	61.7°
N8	C9	H9B	H9A	120.6°	120.0°
C9	N8	C13	H13A	57.0°	58.2°
C9	N8	C13	H13B	177.4°	178.2°
N8	C9	C10	H10B	61.3°	60.7°
N8	C9	C10	H10A	179.1°	179.1°
C13	N8	C9	C10	62.1°	61.8°
N8	C13	C12	C11	59.6°	59.1°
N8	C13	C12	H13A	119.8°	120.0°
N8	C13	C12	H13B	119.8°	120.1°
C13	N8	C9	H9B	178.1°	178.2°
C13	N8	C9	H9A	57.6°	58.3°
N8	C13	H13A	H13B	120.6°	120.0°
N8	C13	C12	H12A	60.5°	179.1°
N8	C13	C12	H12B	179.7°	60.7°
C9	C10	C11	H10B	120.2°	119.9°
C9	C10	C11	H10A	120.2°	120.0°
C9	C10	C11	C12	57.2°	57.6°
C9	C10	C11	C14	177.5°	177.6°
C10	C9	H9B	H9A	120.6°	120.0°
C9	C10	H10B	H10A	119.4°	120.1°
C9	C10	C11	H11	61.9°	62.3°
C10	C11	C12	C14	121.3°	119.9°
C10	C11	C12	H11	119.1°	119.9°
C10	C11	C14	H11	120.4°	120.1°
C10	C11	C12	C13	57.3°	57.6°
C10	C11	C14	C15	35.6°	60.0°
C10	C11	C14	C19	145.8°	119.5°
C11	C10	C9	H9B	178.7°	179.2°
C11	C10	C9	H9A	60.9°	60.9°
C11	C10	H10B	H10A	119.4°	120.1°
C10	C11	C12	H12A	62.7°	177.6°
C10	C11	C12	H12B	177.4°	62.3°
C12	C11	C14	H11	119.4°	120.1°
C11	C12	C13	H12A	120.1°	120.0°
C11	C12	C13	H12B	120.1°	119.9°
C12	C11	C14	C15	84.6°	59.7°
C12	C11	C14	C19	94.0°	120.8°
C11	C12	C13	H13A	60.2°	60.9°
C11	C12	C13	H13B	179.4°	179.2°
C12	C11	C10	H10B	63.0°	62.3°
C12	C11	C10	H10A	177.4°	177.6°
C11	C12	H12A	H12B	119.7°	120.0°
C14	C11	C12	C13	178.6°	177.5°
C11	C14	C15	C19	178.8°	179.5°
C11	C14	C15	C16	179.6°	180.0°
C11	C14	C19	N18	179.7°	179.7°
C11	C14	C19	O20	0.3°	0.5°
C14	C11	C10	H10B	57.3°	57.7°
C14	C11	C10	H10A	62.3°	62.5°
C14	C11	C12	H12A	58.5°	62.4°
C14	C11	C12	H12B	61.3°	57.7°
C11	C14	C15	H15	0.5°	0.0°
C12	C13	H13A	H13B	120.5°	120.0°
C13	C12	C11	H11	61.8°	62.3°
C13	C12	H12A	H12B	119.8°	120.1°
C14	C15	C16	H15	180.0°	180.0°
C14	C15	C16	C17	0.6°	0.1°
C15	C14	C19	N18	1.6°	0.7°
C15	C14	C19	O20	178.5°	180.0°
C14	C15	C16	H16	179.4°	179.7°
C15	C14	C11	H11	156.0°	179.8°
C19	C14	C15	C16	1.7°	0.5°
C14	C19	N18	C17	0.3°	0.5°
C14	C19	N18	O20	179.9°	179.3°
C14	C19	O20	C21	179.7°	180.0°
C19	C14	C11	H11	25.4°	0.6°
C19	C14	C15	H15	178.3°	179.5°
C15	C16	C17	H16	180.0°	179.8°
C15	C16	C17	N18	0.8°	0.2°
C15	C16	C17	H17	179.2°	179.8°
C16	C17	N18	H17	180.0°	180.0°
C16	C17	N18	C19	0.9°	0.0°
C17	C16	C15	H15	179.4°	180.0°
C17	N18	C19	O20	179.8°	179.8°
N18	C17	C16	H16	179.2°	180.0°
N18	C19	O20	C21	0.3°	0.7°
C19	N18	C17	H17	179.1°	180.0°
C19	O20	C21	H21A	180.0°	180.0°
C19	O20	C21	H21C	60.0°	60.0°
C19	O20	C21	H21B	60.0°	60.1°
O20	C21	H21A	H21C	120.0°	119.9°
O20	C21	H21A	H21B	120.0°	120.0°
O20	C21	H21C	H21B	120.0°	120.0°
H7B	C7	H7C	H7A	120.0°	120.0°
H9B	C9	C10	H10B	58.5°	59.3°
H9B	C9	C10	H10A	61.1°	60.8°
H9A	C9	C10	H10B	179.0°	179.2°
H9A	C9	C10	H10A	59.3°	59.1°
H13A	C13	C12	H12A	179.7°	59.1°
H13A	C13	C12	H12B	59.9°	179.3°
H13B	C13	C12	H12A	59.3°	60.8°
H13B	C13	C12	H12B	60.5°	59.3°
H21A	C21	H21C	H21B	120.0°	120.0°
H16	C16	C15	H15	0.6°	0.3°
H16	C16	C17	H17	0.8°	0.0°
H1C	C1	H1B	H1A	120.0°	120.0°
H10B	C10	C11	H11	177.9°	177.8°
H10A	C10	C11	H11	58.3°	57.7°
H11	C11	C12	H12A	178.2°	57.7°
H11	C11	C12	H12B	58.3°	177.8°

Release date:	2026-10-07
Definition date:	2026-07-16
Last modified:	2026-10-02
Release status:	REL
Processing site:	RCSB
Derived from:	37DN