AEP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N	C1	sing	1.46Å	1.49Å
N	HN1	sing	1.02Å	1.02Å
N	HN2	sing	1.02Å	1.02Å
C1	C2	sing	1.53Å	1.63Å
C1	P	sing	1.79Å	1.70Å
C1	H1	sing	1.10Å	1.12Å
C2	C3	sing	1.51Å	1.57Å
C2	H21	sing	1.10Å	1.11Å
C2	H22	sing	1.09Å	1.11Å
C3	O1	doub	1.22Å	1.47Å
C3	O2	sing	1.36Å	1.45Å
O2	HO2	sing	0.98Å	0.95Å
P	C4	sing	1.78Å	1.63Å
P	O1P	doub	1.50Å	20.98Å
P	O2P	sing	1.62Å	20.98Å
C4	C6	sing	1.53Å	1.67Å
C4	H41	sing	1.10Å	1.11Å
C4	H42	sing	1.10Å	1.12Å
C5	C6	sing	1.53Å	1.53Å
C5	H51	sing	1.09Å	1.12Å
C5	H52	sing	1.10Å	1.11Å
C5	H53	sing	1.09Å	1.12Å
C6	C7	sing	1.52Å	1.58Å
C6	H6	sing	1.10Å	1.11Å
C7	O3	doub	1.22Å	1.21Å
C7	O4	sing	1.36Å	1.35Å
O4	HO4	sing	0.98Å	0.95Å
O2P	HOP2	sing	0.98Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C1	N	HN1	114.8°	109.4°
C1	N	HN2	102.7°	109.9°
N	C1	C2	102.6°	110.5°
N	C1	P	111.3°	100.8°
N	C1	H1	113.0°	108.5°
HN1	N	HN2	114.8°	105.5°
C2	C1	P	110.3°	117.8°
C2	C1	H1	114.0°	110.4°
C1	C2	C3	116.8°	112.7°
C1	C2	H21	109.5°	110.4°
C1	C2	H22	109.6°	109.9°
P	C1	H1	105.7°	108.3°
C1	P	C4	103.6°	110.0°
C1	P	O1P	149.1°	113.9°
C1	P	O2P	149.1°	103.8°
C3	C2	H21	109.5°	106.5°
C3	C2	H22	109.6°	108.9°
C2	C3	O1	112.7°	125.3°
C2	C3	O2	129.7°	111.8°
H21	C2	H22	100.6°	108.3°
O1	C3	O2	117.5°	122.9°
C3	O2	HO2	129.8°	115.2°
C4	P	O1P	95.9°	113.2°
C4	P	O2P	95.9°	102.5°
P	C4	C6	113.9°	114.6°
P	C4	H41	110.6°	106.9°
P	C4	H42	110.6°	107.7°
O1P	P	O2P	0.0°	112.5°
P	O2P	HOP2	149.2°	119.0°
C6	C4	H41	110.6°	110.2°
C6	C4	H42	110.6°	110.0°
C4	C6	C5	111.5°	111.7°
C4	C6	C7	118.9°	110.3°
C4	C6	H6	99.3°	109.2°
H41	C4	H42	99.7°	107.1°
C6	C5	H51	111.5°	111.9°
C6	C5	H52	111.5°	110.5°
C6	C5	H53	111.5°	110.9°
C5	C6	C7	102.3°	110.9°
C5	C6	H6	116.7°	107.0°
H51	C5	H52	111.5°	107.2°
H51	C5	H53	98.9°	108.2°
H52	C5	H53	111.5°	107.9°
C7	C6	H6	108.9°	107.6°
C6	C7	O3	119.2°	125.0°
C6	C7	O4	114.3°	112.2°
O3	C7	O4	126.5°	122.8°
C7	O4	HO4	114.3°	115.2°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C1	N	HN1	HN2	118.6°	118.1°
N	C1	C2	P	118.8°	115.1°
N	C1	C2	H1	122.5°	120.0°
N	C1	P	H1	123.1°	113.7°
N	C1	C2	C3	64.4°	60.0°
N	C1	C2	H21	170.3°	59.0°
N	C1	C2	H22	60.9°	178.3°
N	C1	P	C4	157.3°	179.7°
N	C1	P	O1P	29.7°	51.5°
N	C1	P	O2P	29.7°	71.2°
HN1	N	C1	C2	54.7°	61.4°
HN1	N	C1	P	172.8°	173.3°
HN1	N	C1	H1	68.4°	59.7°
HN2	N	C1	C2	180.0°	54.0°
HN2	N	C1	P	62.0°	71.3°
HN2	N	C1	H1	56.8°	175.1°
C2	C1	P	H1	123.6°	126.0°
C1	C2	C3	H21	125.3°	121.2°
C1	C2	C3	H22	125.3°	122.3°
C1	C2	H21	H22	115.3°	120.4°
C1	C2	C3	O1	61.9°	28.8°
C1	C2	C3	O2	120.2°	149.0°
C2	C1	P	C4	89.3°	60.0°
C2	C1	P	O1P	143.0°	171.7°
C2	C1	P	O2P	143.0°	49.0°
P	C1	C2	C3	176.8°	175.0°
P	C1	C2	H21	51.5°	56.1°
P	C1	C2	H22	57.9°	63.3°
C1	P	C4	O1P	155.9°	128.7°
C1	P	C4	O2P	155.9°	109.9°
C1	P	O1P	O2P	90.0°	117.8°
C1	P	C4	C6	146.2°	60.0°
C1	P	C4	H41	20.9°	177.5°
C1	P	C4	H42	88.6°	62.7°
C1	P	O2P	HOP2	180.0°	118.6°
H1	C1	C2	C3	58.1°	60.0°
H1	C1	C2	H21	67.2°	178.9°
H1	C1	C2	H22	176.6°	61.7°
H1	C1	P	C4	34.3°	66.0°
H1	C1	P	O1P	93.4°	62.3°
H1	C1	P	O2P	93.4°	175.1°
C3	C2	H21	H22	115.3°	117.0°
C2	C3	O1	O2	178.2°	177.6°
C2	C3	O2	HO2	180.0°	177.9°
H21	C2	C3	O1	63.3°	150.0°
H21	C2	C3	O2	114.5°	27.8°
H22	C2	C3	O1	172.8°	93.4°
H22	C2	C3	O2	5.1°	88.7°
O1	C3	O2	HO2	2.2°	0.1°
C4	P	O1P	O2P	90.0°	115.6°
P	C4	C6	H41	125.2°	120.7°
P	C4	C6	H42	125.2°	121.5°
P	C4	H41	H42	116.4°	115.2°
P	C4	C6	C5	159.2°	175.6°
P	C4	C6	C7	82.2°	60.7°
P	C4	C6	H6	35.6°	57.4°
C4	P	O2P	HOP2	50.7°	4.1°
O1P	P	C4	C6	57.9°	68.7°
O1P	P	C4	H41	176.8°	53.8°
O1P	P	C4	H42	67.3°	168.6°
O1P	P	O2P	HOP2	90.0°	117.8°
O2P	P	C4	C6	57.9°	169.9°
O2P	P	C4	H41	176.8°	67.6°
O2P	P	C4	H42	67.3°	47.2°
C6	C4	H41	H42	116.5°	119.6°
C4	C6	C5	C7	128.1°	123.5°
C4	C6	C5	H6	113.1°	119.5°
C4	C6	C5	H51	54.7°	120.0°
C4	C6	C5	H52	180.0°	0.6°
C4	C6	C5	H53	54.7°	119.1°
C4	C6	C7	H6	112.6°	119.1°
C4	C6	C7	O3	153.5°	60.9°
C4	C6	C7	O4	27.2°	119.4°
H41	C4	C6	C5	75.6°	63.8°
H41	C4	C6	C7	43.0°	60.0°
H41	C4	C6	H6	160.8°	178.1°
H42	C4	C6	C5	34.0°	54.1°
H42	C4	C6	C7	152.6°	177.9°
H42	C4	C6	H6	89.7°	64.1°
C6	C5	H51	H52	125.3°	121.3°
C6	C5	H51	H53	117.4°	122.5°
C6	C5	H52	H53	125.3°	121.4°
C5	C6	C7	H6	124.2°	116.7°
C5	C6	C7	O3	83.3°	63.4°
C5	C6	C7	O4	96.0°	116.3°
H51	C5	H52	H53	109.5°	116.4°
H51	C5	C6	C7	73.4°	3.5°
H51	C5	C6	H6	167.8°	120.5°
H52	C5	C6	C7	51.9°	122.9°
H52	C5	C6	H6	66.9°	120.1°
H53	C5	C6	C7	177.2°	117.5°
H53	C5	C6	H6	58.4°	0.4°
C6	C7	O3	O4	179.2°	179.6°
C6	C7	O4	HO4	180.0°	179.7°
H6	C6	C7	O3	40.9°	180.0°
H6	C6	C7	O4	139.8°	0.4°
O3	C7	O4	HO4	0.7°	0.0°

Definition date:	2002-04-23
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	1LFW