7UH

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1	C4	doub	1.22Å	1.22Å
C5	N1	sing	1.46Å	1.47Å
C4	N1	sing	1.34Å	1.40Å
C4	N	sing	1.35Å	1.39Å
C	N	sing	1.47Å	1.47Å
N1	C3	sing	1.35Å	1.41Å
N	C1	sing	1.39Å	1.38Å
C3	O	doub	1.22Å	1.23Å
C3	C2	sing	1.41Å	1.43Å
C1	C2	doub	1.39Å	1.37Å	Aromatic
C1	N3	sing	1.34Å	1.36Å	Aromatic
C2	N2	sing	1.38Å	1.38Å	Aromatic
N3	C6	doub	1.31Å	1.32Å	Aromatic
N2	C6	sing	1.35Å	1.36Å	Aromatic
N2	C7	sing	1.47Å	1.47Å
C7	C8	sing	1.53Å	1.52Å
C8	O2	sing	1.44Å	1.41Å
C8	O3	sing	1.44Å	1.43Å
O2	C9	sing	1.44Å	1.43Å
O3	C10	sing	1.45Å	1.43Å
C9	C10	sing	1.54Å	1.47Å
C	H1	sing	1.09Å	1.10Å
C	H2	sing	1.09Å	1.10Å
C	H3	sing	1.09Å	1.10Å
C10	H4	sing	1.09Å	1.10Å
C10	H5	sing	1.09Å	1.10Å
C5	H6	sing	1.09Å	1.10Å
C5	H7	sing	1.09Å	1.10Å
C5	H8	sing	1.09Å	1.10Å
C6	H9	sing	1.08Å	1.08Å
C7	H10	sing	1.09Å	1.10Å
C7	H11	sing	1.09Å	1.10Å
C8	H12	sing	1.09Å	1.10Å
C9	H13	sing	1.09Å	1.10Å
C9	H14	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1	C4	N1	121.4°	119.2°
O1	C4	N	121.3°	119.2°
C5	N1	C4	116.7°	119.5°
C5	N1	C3	117.2°	119.5°
N1	C5	H6	109.5°	109.5°
N1	C5	H7	109.5°	109.5°
N1	C5	H8	109.5°	109.5°
N1	C4	N	117.3°	121.6°
C4	N1	C3	126.1°	121.0°
C4	N	C	118.6°	119.9°
C4	N	C1	119.8°	120.2°
C	N	C1	121.7°	119.9°
N	C	H1	109.5°	109.4°
N	C	H2	109.5°	109.4°
N	C	H3	109.5°	109.5°
N1	C3	O	120.7°	120.4°
N1	C3	C2	112.4°	119.2°
N	C1	C2	121.6°	118.8°
N	C1	N3	126.6°	133.9°
O	C3	C2	126.9°	120.4°
C3	C2	C1	122.8°	119.2°
C3	C2	N2	131.9°	134.6°
C2	C1	N3	111.7°	107.2°
C1	C2	N2	105.3°	106.3°
C1	N3	C6	103.9°	109.8°
C2	N2	C6	105.8°	107.0°
C2	N2	C7	128.8°	126.5°
N3	C6	N2	113.3°	109.7°
N3	C6	H9	123.3°	125.2°
C6	N2	C7	125.4°	126.5°
N2	C6	H9	123.4°	125.2°
N2	C7	C8	114.7°	109.5°
N2	C7	H10	108.1°	109.5°
N2	C7	H11	108.1°	109.4°
C7	C8	O2	108.1°	110.1°
C7	C8	O3	111.0°	110.1°
C8	C7	H10	108.2°	109.5°
C8	C7	H11	108.2°	109.5°
C7	C8	H12	109.6°	110.1°
O2	C8	O3	106.1°	106.2°
C8	O2	C9	105.7°	107.1°
O2	C8	H12	111.1°	110.1°
C8	O3	C10	108.1°	103.2°
O3	C8	H12	110.8°	110.2°
O2	C9	C10	103.6°	105.1°
O2	C9	H13	110.9°	110.3°
O2	C9	H14	110.9°	110.3°
O3	C10	C9	104.4°	102.9°
O3	C10	H4	110.7°	110.7°
O3	C10	H5	110.8°	110.9°
C9	C10	H4	110.7°	110.7°
C9	C10	H5	110.7°	110.8°
C10	C9	H13	110.9°	110.3°
C10	C9	H14	110.9°	110.3°
H1	C	H2	109.5°	109.4°
H1	C	H3	109.4°	109.5°
H2	C	H3	109.5°	109.5°
H4	C10	H5	109.5°	110.7°
H6	C5	H7	109.5°	109.5°
H6	C5	H8	109.5°	109.4°
H7	C5	H8	109.5°	109.5°
H10	C7	H11	109.5°	109.5°
H13	C9	H14	109.5°	110.3°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1	C4	N1	C5	0.7°	0.0°
O1	C4	N1	N	179.6°	180.0°
O1	C4	N	C	1.5°	0.0°
O1	C4	N1	C3	179.5°	179.3°
O1	C4	N	C1	179.4°	179.5°
C5	N1	C4	C3	179.8°	179.3°
C5	N1	C4	N	179.7°	180.0°
C5	N1	C3	O	1.5°	0.3°
C5	N1	C3	C2	179.5°	179.7°
N1	C5	H6	H7	120.0°	120.1°
N1	C5	H6	H8	120.0°	120.0°
N1	C5	H7	H8	120.0°	120.0°
N1	C4	N	C	178.8°	180.0°
N1	C4	N	C1	0.3°	0.5°
C4	N1	C3	O	178.7°	179.6°
C4	N1	C3	C2	0.3°	0.5°
C4	N1	C5	H6	180.0°	0.0°
C4	N1	C5	H7	60.0°	120.0°
C4	N1	C5	H8	60.0°	120.0°
C4	N	C	C1	179.1°	179.5°
N	C4	N1	C3	0.1°	0.7°
C4	N	C1	C2	0.7°	0.0°
C4	N	C1	N3	179.5°	179.7°
C4	N	C	H1	180.0°	0.0°
C4	N	C	H2	60.0°	120.0°
C4	N	C	H3	60.0°	120.0°
C	N	C1	C2	178.4°	179.5°
C	N	C1	N3	0.4°	0.2°
N	C	H1	H2	120.0°	119.9°
N	C	H1	H3	120.0°	120.1°
N	C	H2	H3	120.0°	120.0°
N1	C3	O	C2	178.9°	179.9°
N1	C3	C2	C1	0.8°	0.0°
N1	C3	C2	N2	177.9°	180.0°
C3	N1	C5	H6	0.2°	179.3°
C3	N1	C5	H7	119.9°	59.3°
C3	N1	C5	H8	120.2°	60.7°
N	C1	C2	C3	1.0°	0.2°
N	C1	C2	N3	178.9°	179.8°
N	C1	C2	N2	178.0°	179.8°
N	C1	N3	C6	178.1°	179.7°
C1	N	C	H1	0.9°	179.6°
C1	N	C	H2	120.9°	60.5°
C1	N	C	H3	119.1°	59.5°
O	C3	C2	C1	178.2°	180.0°
O	C3	C2	N2	3.1°	0.1°
C3	C2	C1	N2	179.0°	180.0°
C3	C2	C1	N3	179.9°	180.0°
C3	C2	N2	C6	179.6°	180.0°
C3	C2	N2	C7	2.4°	0.0°
C2	C1	N3	C6	0.7°	0.0°
C1	C2	N2	C6	0.8°	0.0°
C1	C2	N2	C7	176.4°	180.0°
N3	C1	C2	N2	0.9°	0.0°
C1	N3	C6	N2	0.2°	0.0°
C1	N3	C6	H9	179.8°	180.0°
C2	N2	C6	N3	0.4°	0.0°
C2	N2	C6	C7	177.3°	180.0°
C2	N2	C7	C8	112.4°	85.0°
C2	N2	C6	H9	179.6°	180.0°
C2	N2	C7	H10	126.8°	35.0°
C2	N2	C7	H11	8.4°	155.0°
N3	C6	N2	H9	180.0°	180.0°
N3	C6	N2	C7	176.9°	180.0°
C6	N2	C7	C8	70.9°	95.0°
C6	N2	C7	H10	49.9°	144.9°
C6	N2	C7	H11	168.3°	25.0°
N2	C7	C8	H10	120.8°	120.0°
N2	C7	C8	H11	120.8°	120.0°
N2	C7	C8	O2	174.2°	175.0°
N2	C7	C8	O3	69.8°	68.2°
C7	N2	C6	H9	3.1°	0.0°
N2	C7	H10	H11	117.6°	119.9°
N2	C7	C8	H12	52.9°	53.4°
C7	C8	O2	O3	119.2°	119.2°
C7	C8	O2	H12	120.3°	121.6°
C7	C8	O3	H12	122.0°	121.6°
C7	C8	O2	C9	90.5°	144.3°
C7	C8	O3	C10	107.1°	158.4°
C8	C7	H10	H11	117.6°	120.0°
O2	C8	O3	H12	120.7°	119.2°
O2	C8	O3	C10	10.1°	39.2°
C8	O2	C9	C10	35.5°	1.7°
O2	C8	C7	H10	65.1°	55.0°
O2	C8	C7	H11	53.4°	65.0°
C8	O2	C9	H13	83.6°	120.6°
C8	O2	C9	H14	154.6°	117.2°
O3	C8	O2	C9	28.7°	25.1°
C8	O3	C10	C9	11.5°	36.6°
C8	O3	C10	H4	107.6°	154.9°
C8	O3	C10	H5	130.7°	81.8°
O3	C8	C7	H10	50.9°	171.8°
O3	C8	C7	H11	169.4°	51.7°
O2	C9	C10	O3	28.6°	21.8°
O2	C9	C10	H13	119.1°	118.9°
O2	C9	C10	H14	119.1°	118.9°
O2	C9	C10	H4	90.6°	140.1°
O2	C9	C10	H5	147.8°	96.7°
C9	O2	C8	H12	149.2°	94.1°
O2	C9	H13	H14	122.7°	122.1°
O3	C10	C9	H4	119.2°	118.3°
O3	C10	C9	H5	119.2°	118.5°
O3	C10	H4	H5	122.4°	123.3°
C10	O3	C8	H12	130.9°	80.0°
O3	C10	C9	H13	90.4°	97.1°
O3	C10	C9	H14	147.7°	140.7°
C9	C10	H4	H5	122.3°	123.2°
C10	C9	H13	H14	122.7°	122.2°
H1	C	H2	H3	119.9°	120.0°
H4	C10	C9	H13	150.4°	21.2°
H4	C10	C9	H14	28.5°	101.0°
H5	C10	C9	H13	28.8°	144.4°
H5	C10	C9	H14	93.1°	22.2°
H6	C5	H7	H8	120.0°	119.9°
H10	C7	C8	H12	173.7°	66.6°
H11	C7	C8	H12	67.9°	173.4°

Release date:	2023-02-01
Definition date:	2021-10-27
Last modified:	2023-09-20
Release status:	REL
Processing site:	PDBJ
Derived from:	7VRZ