N68

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1	C1	sing	1.47Å	1.47Å
C1	C2	sing	1.53Å	1.55Å
C2	C3	sing	1.53Å	1.56Å
C3	C4	sing	1.53Å	1.55Å
C4	C5	sing	1.53Å	1.55Å
C5	C6	sing	1.53Å	1.55Å
C6	O	sing	1.43Å	1.34Å
O	P	sing	1.61Å	1.52Å
P	OP1	sing	1.61Å	1.51Å
P	OP2	sing	1.61Å	1.51Å
P	OP3	doub	1.48Å	1.48Å
N1	HN11	sing	1.01Å	1.00Å
N1	HN12	sing	1.01Å	1.00Å
C1	H11	sing	1.09Å	1.10Å
C1	H12	sing	1.09Å	1.10Å
C2	H21	sing	1.09Å	1.10Å
C2	H22	sing	1.09Å	1.10Å
C3	H31	sing	1.09Å	1.10Å
C3	H32	sing	1.09Å	1.10Å
C4	H41	sing	1.09Å	1.10Å
C4	H42	sing	1.09Å	1.10Å
C5	H51	sing	1.09Å	1.10Å
C5	H52	sing	1.09Å	1.10Å
C6	H61	sing	1.09Å	1.10Å
C6	H62	sing	1.09Å	1.10Å
OP1	HN21	sing	0.97Å	0.95Å
OP2	HN22	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
N1	C1	C2	110.9°	109.4°
C1	N1	HN11	109.5°	111.0°
C1	N1	HN12	109.4°	111.0°
N1	C1	H11	109.0°	109.4°
N1	C1	H12	109.0°	109.4°
C1	C2	C3	114.4°	109.4°
C2	C1	H11	109.0°	109.5°
C2	C1	H12	109.0°	109.5°
C1	C2	H21	107.9°	109.5°
C1	C2	H22	107.8°	109.5°
C2	C3	C4	111.8°	109.5°
C3	C2	H21	107.8°	109.4°
C3	C2	H22	107.9°	109.4°
C2	C3	H31	108.7°	109.4°
C2	C3	H32	108.7°	109.4°
C3	C4	C5	113.9°	109.4°
C4	C3	H31	108.7°	109.5°
C4	C3	H32	108.7°	109.5°
C3	C4	H41	108.0°	109.5°
C3	C4	H42	108.0°	109.4°
C4	C5	C6	111.6°	109.4°
C5	C4	H41	108.0°	109.5°
C5	C4	H42	108.0°	109.5°
C4	C5	H51	108.8°	109.5°
C4	C5	H52	108.8°	109.4°
C5	C6	O	110.8°	109.5°
C6	C5	H51	108.8°	109.5°
C6	C5	H52	108.8°	109.5°
C5	C6	H61	109.0°	109.5°
C5	C6	H62	109.0°	109.4°
C6	O	P	125.8°	123.0°
O	C6	H61	109.0°	109.5°
O	C6	H62	109.1°	109.5°
O	P	OP1	108.8°	109.5°
O	P	OP2	109.5°	109.5°
O	P	OP3	110.2°	109.5°
OP1	P	OP2	108.8°	109.5°
OP1	P	OP3	109.6°	109.5°
P	OP1	HN21	109.5°	114.0°
OP2	P	OP3	109.8°	109.4°
P	OP2	HN22	109.5°	113.9°
HN11	N1	HN12	109.5°	110.9°
H11	C1	H12	109.9°	109.5°
H21	C2	H22	111.1°	109.5°
H31	C3	H32	110.2°	109.5°
H41	C4	H42	110.9°	109.5°
H51	C5	H52	110.2°	109.5°
H61	C6	H62	109.9°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N1	C1	C2	H11	120.0°	120.0°
N1	C1	C2	H12	120.0°	119.9°
N1	C1	C2	C3	179.9°	180.0°
C1	N1	HN11	HN12	120.0°	123.9°
N1	C1	H11	H12	119.4°	120.0°
N1	C1	C2	H21	60.0°	60.0°
N1	C1	C2	H22	60.1°	60.1°
C1	C2	C3	H21	120.0°	120.0°
C1	C2	C3	H22	120.0°	120.0°
C1	C2	C3	C4	179.9°	180.0°
C2	C1	N1	HN11	180.0°	56.1°
C2	C1	N1	HN12	60.0°	180.0°
C2	C1	H11	H12	119.4°	120.1°
C1	C2	H21	H22	118.0°	120.1°
C1	C2	C3	H31	60.1°	60.0°
C1	C2	C3	H32	59.9°	60.0°
C2	C3	C4	H31	120.0°	120.0°
C2	C3	C4	H32	120.0°	119.9°
C2	C3	C4	C5	179.7°	180.0°
C3	C2	C1	H11	60.1°	60.0°
C3	C2	C1	H12	59.9°	60.1°
C3	C2	H21	H22	118.0°	119.9°
C2	C3	H31	H32	119.0°	119.9°
C2	C3	C4	H41	59.7°	60.0°
C2	C3	C4	H42	60.3°	60.0°
C3	C4	C5	H41	120.0°	120.0°
C3	C4	C5	H42	120.0°	119.9°
C3	C4	C5	C6	179.8°	180.0°
C4	C3	C2	H21	59.9°	60.0°
C4	C3	C2	H22	60.1°	60.0°
C4	C3	H31	H32	119.0°	120.0°
C3	C4	H41	H42	118.2°	120.0°
C3	C4	C5	H51	59.8°	60.0°
C3	C4	C5	H52	60.1°	60.0°
C4	C5	C6	H51	120.0°	120.0°
C4	C5	C6	H52	120.0°	119.9°
C4	C5	C6	O	179.8°	180.0°
C5	C4	C3	H31	60.3°	60.0°
C5	C4	C3	H32	59.7°	60.1°
C5	C4	H41	H42	118.2°	120.0°
C4	C5	H51	H52	119.1°	120.0°
C4	C5	C6	H61	60.2°	60.0°
C4	C5	C6	H62	59.8°	60.0°
C5	C6	O	H61	120.0°	120.0°
C5	C6	O	H62	120.0°	119.9°
C5	C6	O	P	178.9°	180.0°
C6	C5	C4	H41	60.1°	60.0°
C6	C5	C4	H42	59.9°	60.1°
C6	C5	H51	H52	119.2°	120.0°
C5	C6	H61	H62	119.5°	120.0°
C6	O	P	OP1	179.3°	175.0°
C6	O	P	OP2	60.4°	65.0°
C6	O	P	OP3	60.5°	55.0°
O	C6	C5	H51	59.8°	60.0°
O	C6	C5	H52	60.2°	60.1°
O	C6	H61	H62	119.5°	120.0°
O	P	OP1	OP2	119.3°	120.0°
O	P	OP1	OP3	120.6°	120.0°
O	P	OP2	OP3	121.1°	120.0°
P	O	C6	H61	61.1°	60.0°
P	O	C6	H62	58.9°	60.0°
O	P	OP1	HN21	120.6°	180.0°
O	P	OP2	HN22	121.2°	60.0°
OP1	P	OP2	OP3	120.0°	120.0°
OP1	P	OP2	HN22	120.0°	60.0°
OP2	P	OP1	HN21	120.1°	60.0°
OP3	P	OP1	HN21	0.0°	60.0°
OP3	P	OP2	HN22	0.0°	180.0°
HN11	N1	C1	H11	60.0°	176.1°
HN11	N1	C1	H12	60.0°	63.9°
HN12	N1	C1	H11	60.0°	60.0°
HN12	N1	C1	H12	180.0°	60.0°
H11	C1	C2	H21	179.9°	180.0°
H11	C1	C2	H22	59.9°	59.9°
H12	C1	C2	H21	60.1°	59.9°
H12	C1	C2	H22	179.9°	180.0°
H21	C2	C3	H31	179.9°	180.0°
H21	C2	C3	H32	60.1°	60.0°
H22	C2	C3	H31	59.9°	60.0°
H22	C2	C3	H32	179.9°	180.0°
H31	C3	C4	H41	179.7°	180.0°
H31	C3	C4	H42	59.7°	60.0°
H32	C3	C4	H41	60.4°	60.0°
H32	C3	C4	H42	179.7°	180.0°
H41	C4	C5	H51	179.8°	180.0°
H41	C4	C5	H52	59.9°	60.0°
H42	C4	C5	H51	60.1°	59.9°
H42	C4	C5	H52	179.9°	180.0°
H51	C5	C6	H61	179.8°	180.0°
H51	C5	C6	H62	60.2°	60.0°
H52	C5	C6	H61	59.8°	60.0°
H52	C5	C6	H62	179.8°	180.0°

Definition date:	2011-05-31
Last modified:	2011-12-02
Release status:	REL
Processing site:	RCSB
Derived from:	2L5K