A1DWM

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C5	C6	sing	1.53Å	1.54Å
C5	C4	sing	1.53Å	1.54Å
C1	C2	sing	1.53Å	1.54Å
C6	N1	sing	1.47Å	1.45Å
C4	C2	sing	1.53Å	1.54Å
C4	N1	sing	1.47Å	1.46Å
C3	C2	sing	1.53Å	1.54Å
C2	O1	sing	1.43Å	1.42Å
N1	C7	sing	1.38Å	1.41Å
C7	C12	doub	1.40Å	1.42Å	Aromatic
C7	N2	sing	1.33Å	1.36Å	Aromatic
C11	C12	sing	1.46Å	1.44Å	Aromatic
C11	C10	doub	1.34Å	1.37Å	Aromatic
C12	C9	sing	1.41Å	1.41Å	Aromatic
N2	C8	doub	1.32Å	1.33Å	Aromatic
C10	N4	sing	1.37Å	1.39Å	Aromatic
C8	N3	sing	1.32Å	1.33Å	Aromatic
C9	N4	sing	1.37Å	1.37Å	Aromatic
C9	N3	doub	1.33Å	1.36Å	Aromatic
C11	H16	sing	1.08Å	1.08Å
C1	H2	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C1	H1	sing	1.09Å	1.10Å
C10	H15	sing	1.08Å	1.08Å
C3	H5	sing	1.09Å	1.10Å
C3	H4	sing	1.09Å	1.10Å
C3	H6	sing	1.09Å	1.10Å
C4	H8	sing	1.09Å	1.10Å
C5	H10	sing	1.09Å	1.10Å
C5	H9	sing	1.09Å	1.10Å
C6	H12	sing	1.09Å	1.10Å
C6	H11	sing	1.09Å	1.10Å
C8	H13	sing	1.08Å	1.08Å
N4	H14	sing	0.97Å	1.00Å
O1	H7	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C6	C5	C4	91.1°	83.6°
C5	C6	N1	85.1°	87.9°
C6	C5	H10	113.9°	114.2°
C6	C5	H9	113.9°	114.2°
C5	C6	H12	115.2°	113.5°
C5	C6	H11	115.2°	113.5°
C5	C4	C2	121.8°	113.5°
C5	C4	N1	84.8°	87.9°
C5	C4	H8	110.5°	113.6°
C4	C5	H10	113.8°	114.1°
C4	C5	H9	113.8°	114.2°
C1	C2	C4	111.0°	109.5°
C1	C2	C3	109.7°	109.5°
C1	C2	O1	108.6°	109.5°
C2	C1	H2	109.5°	109.4°
C2	C1	H3	109.5°	109.5°
C2	C1	H1	109.5°	109.5°
C6	N1	C4	98.5°	87.8°
C6	N1	C7	129.6°	111.0°
N1	C6	H12	115.2°	113.5°
N1	C6	H11	115.1°	113.5°
C2	C4	N1	115.1°	113.5°
C4	C2	C3	111.7°	109.5°
C4	C2	O1	109.3°	109.4°
C2	C4	H8	110.6°	112.7°
C4	N1	C7	126.7°	111.0°
N1	C4	H8	111.7°	113.5°
C3	C2	O1	106.4°	109.5°
C2	C3	H5	109.5°	109.5°
C2	C3	H4	109.5°	109.5°
C2	C3	H6	109.4°	109.4°
C2	O1	H7	109.5°	114.0°
N1	C7	C12	124.8°	120.9°
N1	C7	N2	117.7°	120.8°
C12	C7	N2	117.5°	118.3°
C7	C12	C11	137.1°	135.1°
C7	C12	C9	115.5°	118.7°
C7	N2	C8	121.0°	121.0°
C12	C11	C10	106.3°	106.8°
C11	C12	C9	107.4°	106.2°
C12	C11	H16	126.9°	126.6°
C11	C10	N4	109.6°	109.8°
C10	C11	H16	126.9°	126.6°
C11	C10	H15	125.2°	125.1°
C12	C9	N4	107.4°	107.2°
C12	C9	N3	126.3°	118.6°
N2	C8	N3	127.3°	122.7°
N2	C8	H13	116.3°	118.6°
C10	N4	C9	109.4°	110.0°
N4	C10	H15	125.2°	125.1°
C10	N4	H14	125.3°	125.0°
C8	N3	C9	112.4°	120.7°
N3	C8	H13	116.4°	118.7°
N4	C9	N3	126.3°	134.3°
C9	N4	H14	125.3°	125.1°
H2	C1	H3	109.5°	109.4°
H2	C1	H1	109.4°	109.5°
H3	C1	H1	109.5°	109.5°
H5	C3	H4	109.5°	109.5°
H5	C3	H6	109.4°	109.5°
H4	C3	H6	109.5°	109.5°
H10	C5	H9	109.5°	113.4°
H12	C6	H11	109.5°	112.7°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C6	C5	C4	H10	116.8°	113.6°
C6	C5	C4	H9	116.8°	113.7°
C5	C6	N1	H12	115.6°	114.8°
C5	C6	N1	H11	115.6°	114.8°
C6	C5	C4	C2	121.4°	140.8°
C6	C5	C4	N1	5.0°	26.0°
C5	C6	N1	C7	160.6°	138.7°
C6	C5	C4	H8	106.3°	88.7°
C6	C5	H10	H9	128.7°	133.1°
C5	C6	H12	H11	131.7°	130.8°
C5	C4	C2	C1	65.5°	86.7°
C5	C4	C2	N1	100.0°	98.4°
C5	C4	C2	H8	132.3°	130.9°
C5	C4	N1	H8	110.0°	114.9°
C5	C4	C2	C3	57.2°	153.4°
C5	C4	C2	O1	174.6°	33.4°
C5	C4	N1	C7	161.6°	138.7°
C4	C5	H10	H9	128.7°	133.1°
C4	C5	C6	H12	110.6°	88.8°
C4	C5	C6	H11	120.5°	140.8°
C1	C2	C4	C3	122.7°	120.0°
C1	C2	C4	O1	119.8°	120.0°
C1	C2	C4	N1	165.5°	175.0°
C1	C2	C3	O1	117.3°	120.0°
C2	C1	H2	H3	120.0°	120.0°
C2	C1	H2	H1	120.0°	120.0°
C2	C1	H3	H1	120.0°	120.0°
C1	C2	C3	H5	180.0°	60.0°
C1	C2	C3	H4	60.0°	180.0°
C1	C2	C3	H6	60.0°	60.0°
C1	C2	C4	H8	66.7°	44.3°
C1	C2	O1	H7	180.0°	59.9°
C6	N1	C4	C2	128.2°	141.8°
C6	N1	C4	C7	156.3°	111.7°
C6	N1	C7	C12	18.2°	84.0°
C6	N1	C7	N2	164.0°	95.9°
C6	N1	C4	H8	104.7°	87.9°
N1	C6	C5	H10	111.8°	139.6°
N1	C6	C5	H9	121.8°	87.6°
N1	C6	H12	H11	131.6°	130.8°
C2	C4	N1	H8	127.2°	130.3°
C4	C2	C3	O1	119.2°	120.0°
C2	C4	N1	C7	75.5°	106.5°
C4	C2	C1	H2	180.0°	60.0°
C4	C2	C1	H3	60.0°	60.0°
C4	C2	C1	H1	60.0°	180.0°
C4	C2	C3	H5	56.5°	60.0°
C4	C2	C3	H4	63.5°	60.0°
C4	C2	C3	H6	176.5°	180.0°
C2	C4	C5	H10	4.6°	105.6°
C2	C4	C5	H9	121.9°	27.1°
C4	C2	O1	H7	58.7°	179.9°
N1	C4	C2	C3	42.8°	55.0°
N1	C4	C2	O1	74.6°	65.0°
C4	N1	C7	C12	167.1°	180.0°
C4	N1	C7	N2	15.1°	0.0°
N1	C4	C5	H10	111.8°	139.7°
N1	C4	C5	H9	121.7°	87.6°
C4	N1	C6	H12	110.3°	87.8°
C4	N1	C6	H11	120.9°	141.8°
C3	C2	C1	H2	56.1°	180.0°
C3	C2	C1	H3	63.9°	60.0°
C3	C2	C1	H1	176.1°	60.0°
C2	C3	H5	H4	120.0°	120.0°
C2	C3	H5	H6	120.0°	119.9°
C2	C3	H4	H6	120.0°	119.9°
C3	C2	C4	H8	170.5°	75.7°
C3	C2	O1	H7	62.0°	60.1°
O1	C2	C1	H2	59.7°	60.0°
O1	C2	C1	H3	179.8°	180.0°
O1	C2	C1	H1	60.2°	60.0°
O1	C2	C3	H5	62.7°	180.0°
O1	C2	C3	H4	177.3°	59.9°
O1	C2	C3	H6	57.3°	60.0°
O1	C2	C4	H8	53.1°	164.3°
N1	C7	C12	N2	177.8°	180.0°
N1	C7	C12	C11	1.7°	0.0°
N1	C7	C12	C9	178.1°	180.0°
N1	C7	N2	C8	178.6°	180.0°
C7	N1	C4	H8	51.6°	23.8°
C7	N1	C6	H12	45.0°	23.9°
C7	N1	C6	H11	83.9°	106.5°
C7	C12	C11	C9	179.8°	180.0°
C7	C12	C11	C10	179.9°	180.0°
C12	C7	N2	C8	0.7°	0.0°
C7	C12	C9	N4	179.6°	180.0°
C7	C12	C9	N3	0.2°	0.1°
C7	C12	C11	H16	0.1°	0.2°
N2	C7	C12	C11	179.5°	180.0°
N2	C7	C12	C9	0.3°	0.0°
C7	N2	C8	N3	1.1°	0.1°
C7	N2	C8	H13	178.9°	180.0°
C12	C11	C10	H16	180.0°	179.8°
C12	C11	C10	N4	0.4°	0.0°
C11	C12	C9	N4	0.2°	0.0°
C11	C12	C9	N3	179.6°	179.9°
C12	C11	C10	H15	179.6°	180.0°
C10	C11	C12	C9	0.1°	0.0°
C11	C10	N4	H15	180.0°	180.0°
C11	C10	N4	C9	0.5°	0.0°
C11	C10	N4	H14	179.5°	180.0°
C12	C9	N4	C10	0.5°	0.0°
C12	C9	N3	C8	0.4°	0.1°
C12	C9	N4	N3	179.4°	179.9°
C9	C12	C11	H16	179.9°	179.8°
C12	C9	N4	H14	179.6°	180.0°
N2	C8	N3	H13	180.0°	179.9°
N2	C8	N3	C9	0.9°	0.1°
C10	N4	C9	H14	180.0°	180.0°
C10	N4	C9	N3	179.9°	179.9°
N4	C10	C11	H16	179.6°	179.8°
C8	N3	C9	N4	179.7°	180.0°
C9	N4	C10	H15	179.5°	180.0°
C9	N3	C8	H13	179.1°	180.0°
N3	C9	N4	H14	0.2°	0.1°
H16	C11	C10	H15	0.4°	0.3°
H2	C1	H3	H1	120.0°	120.0°
H15	C10	N4	H14	0.5°	0.0°
H5	C3	H4	H6	120.0°	120.1°
H8	C4	C5	H10	136.9°	24.9°
H8	C4	C5	H9	10.5°	157.6°
H10	C5	C6	H12	132.6°	24.8°
H10	C5	C6	H11	3.7°	105.6°
H9	C5	C6	H12	6.2°	157.6°
H9	C5	C6	H11	122.7°	27.1°

Release date:	2026-11-04
Definition date:	2026-08-24
Last modified:	2026-10-30
Release status:	REL
Processing site:	RCSB
Derived from:	15MO