HA5

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O2	N1	sing	0.00Å	1.47Å
C3	O2	sing	0.00Å	1.35Å
C4	C3	sing	0.00Å	1.49Å
C4	H4	sing	0.00Å	1.10Å
C4	H4A	sing	0.00Å	1.10Å
N5	C4	sing	0.00Å	1.51Å
N5	HN5	sing	0.00Å	1.00Å
C6	N5	sing	0.00Å	1.51Å
C6	C10	sing	0.00Å	1.55Å
C6	H6	sing	0.00Å	1.10Å
C7	C6	sing	0.00Å	1.55Å
O8	C7	sing	0.00Å	1.24Å
O8	HO8	sing	0.00Å	0.95Å
O9	C7	doub	0.00Å	1.26Å
C10	C11	sing	0.00Å	1.50Å
C10	H10	sing	0.00Å	1.10Å
C10	H10A	sing	0.00Å	1.10Å
C11	C3	doub	0.00Å	1.35Å
C11	C12	sing	0.00Å	1.47Å
C12	N1	doub	0.00Å	1.36Å
C12	O13	sing	0.00Å	1.26Å
O13	H8	sing	0.00Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N1	O2	C3	106.7°	90.0°
O2	N1	C12	105.8°	90.0°
O2	C3	C4	121.4°	90.0°
O2	C3	C11	112.9°	90.0°
C3	C4	H4	111.0°	90.0°
C3	C4	H4A	111.0°	90.0°
C3	C4	N5	105.0°	90.0°
C4	C3	C11	125.7°	90.0°
H4	C4	H4A	107.9°	90.0°
H4	C4	N5	111.0°	90.0°
H4A	C4	N5	111.0°	90.0°
C4	N5	HN5	110.0°	90.0°
C4	N5	C6	107.8°	90.0°
HN5	N5	C6	110.0°	90.0°
N5	C6	C10	109.8°	90.0°
N5	C6	H6	112.1°	90.0°
N5	C6	C7	109.1°	90.0°
C10	C6	H6	104.4°	90.0°
C10	C6	C7	116.1°	90.0°
C6	C10	C11	108.2°	90.0°
C6	C10	H10	109.9°	90.0°
C6	C10	H10A	109.9°	90.0°
H6	C6	C7	105.3°	90.0°
C6	C7	O8	113.4°	90.0°
C6	C7	O9	117.4°	90.0°
C7	O8	HO8	109.5°	90.0°
O8	C7	O9	129.2°	90.0°
C11	C10	H10	109.9°	90.0°
C11	C10	H10A	109.9°	90.0°
C10	C11	C3	123.2°	90.0°
C10	C11	C12	131.8°	90.0°
H10	C10	H10A	109.0°	90.0°
C3	C11	C12	105.0°	90.0°
C11	C12	N1	109.5°	90.0°
C11	C12	O13	126.3°	90.0°
N1	C12	O13	124.2°	90.0°
C12	O13	H8	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N1	O2	C3	C4	179.6°	90.0°
N1	O2	C3	C11	1.2°	90.0°
O2	N1	C12	C11	0.6°	90.0°
O2	N1	C12	O13	178.7°	90.0°
O2	C3	C4	C11	178.2°	90.0°
O2	C3	C4	H4	86.6°	90.0°
O2	C3	C4	H4A	33.4°	90.0°
O2	C3	C4	N5	153.4°	90.0°
O2	C3	C11	C10	178.9°	90.0°
O2	C3	C11	C12	0.8°	90.0°
C3	O2	N1	C12	1.1°	90.0°
C3	C4	H4	H4A	121.9°	90.0°
C3	C4	H4	N5	116.3°	90.0°
C3	C4	H4A	N5	116.4°	90.0°
C3	C4	N5	HN5	179.1°	90.0°
C3	C4	N5	C6	59.1°	90.0°
C4	C3	C11	C10	0.5°	90.0°
C4	C3	C11	C12	179.2°	90.0°
H4	C4	H4A	N5	121.8°	90.0°
H4	C4	N5	HN5	59.1°	90.0°
H4	C4	N5	C6	60.9°	90.0°
H4	C4	C3	C11	95.2°	90.0°
H4A	C4	N5	HN5	60.9°	90.0°
H4A	C4	N5	C6	179.1°	90.0°
H4A	C4	C3	C11	144.8°	90.0°
C4	N5	HN5	C6	118.7°	90.0°
C4	N5	C6	C10	73.4°	90.0°
C4	N5	C6	H6	42.2°	90.0°
C4	N5	C6	C7	158.4°	90.0°
N5	C4	C3	C11	24.8°	90.0°
HN5	N5	C6	C10	166.6°	90.0°
HN5	N5	C6	H6	77.8°	90.0°
HN5	N5	C6	C7	38.4°	90.0°
N5	C6	C10	H6	120.4°	90.0°
N5	C6	C10	C7	124.3°	90.0°
N5	C6	H6	C7	118.4°	90.0°
N5	C6	C7	O8	160.0°	90.0°
N5	C6	C7	O9	20.3°	90.0°
N5	C6	C10	C11	43.8°	90.0°
N5	C6	C10	H10	163.8°	90.0°
N5	C6	C10	H10A	76.2°	90.0°
C10	C6	H6	C7	122.7°	90.0°
C10	C6	C7	O8	35.3°	90.0°
C10	C6	C7	O9	145.0°	90.0°
C6	C10	C11	H10	120.0°	90.0°
C6	C10	C11	H10A	120.0°	90.0°
C6	C10	H10	H10A	120.5°	90.0°
C6	C10	C11	C3	8.6°	90.0°
C6	C10	C11	C12	171.8°	90.0°
H6	C6	C7	O8	79.6°	90.0°
H6	C6	C7	O9	100.1°	90.0°
H6	C6	C10	C11	76.6°	90.0°
H6	C6	C10	H10	43.4°	90.0°
H6	C6	C10	H10A	163.4°	90.0°
C6	C7	O8	O9	179.7°	90.0°
C6	C7	O8	HO8	179.6°	90.0°
C7	C6	C10	C11	168.0°	90.0°
C7	C6	C10	H10	72.0°	90.0°
C7	C6	C10	H10A	48.0°	90.0°
HO8	O8	C7	O9	0.0°	90.0°
C11	C10	H10	H10A	120.5°	90.0°
C10	C11	C3	C12	179.7°	90.0°
C10	C11	C12	N1	179.6°	90.0°
C10	C11	C12	O13	0.3°	90.0°
H10	C10	C11	C3	128.6°	90.0°
H10	C10	C11	C12	51.8°	90.0°
H10A	C10	C11	C3	111.4°	90.0°
H10A	C10	C11	C12	68.2°	90.0°
C3	C11	C12	N1	0.1°	90.0°
C3	C11	C12	O13	179.4°	90.0°
C11	C12	N1	O13	179.3°	90.0°
C11	C12	O13	H8	179.2°	90.0°
N1	C12	O13	H8	0.0°	90.0°

Definition date:	2010-10-29
Last modified:	2012-01-05
Release status:	REL
Processing site:	RCSB
Derived from:	3PD9