FAI

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
OP1	P	doub	1.48Å	1.61Å
O5	C6	doub	1.22Å	1.23Å
O6	C8	doub	1.21Å	1.25Å
OP2	P	sing	1.61Å	1.62Å
N1	C3A	sing	1.36Å	1.33Å	Aromatic
N1	C5	doub	1.30Å	1.33Å	Aromatic
C6	C3A	sing	1.47Å	1.52Å
C6	N2	sing	1.35Å	1.34Å
O3	P	sing	1.61Å	1.59Å
O3	C4	sing	1.43Å	1.43Å
C3A	C7A	doub	1.39Å	1.38Å	Aromatic
O	C	sing	1.44Å	1.43Å
O	C1	sing	1.44Å	1.42Å
P	OP3	sing	1.61Å	1.49Å
C5	N	sing	1.36Å	1.34Å	Aromatic
C4	C	sing	1.53Å	1.53Å
C8	N3	sing	1.35Å	1.35Å
C7A	N	sing	1.36Å	1.33Å	Aromatic
C7A	N3	sing	1.39Å	1.34Å
N	C1	sing	1.46Å	1.47Å
C	C3	sing	1.55Å	1.54Å
C1	C2	sing	1.55Å	1.52Å
C3	C2	sing	1.55Å	1.53Å
C3	O3'	sing	1.43Å	1.43Å
C2	O2'	sing	1.43Å	1.44Å
OP2	HOP2	sing	0.97Å	0.95Å
OP3	HOP3	sing	0.97Å	0.95Å
C4	H41	sing	1.09Å	1.10Å
C4	H42	sing	1.09Å	1.10Å
C	H	sing	1.09Å	1.10Å
C3	H3	sing	1.09Å	1.10Å
O3'	HO3'	sing	0.97Å	0.95Å
C2	H2	sing	1.09Å	1.10Å
O2'	HO2'	sing	0.97Å	0.95Å
C1	H1	sing	1.09Å	1.10Å
C5	H5	sing	1.08Å	1.08Å
N2	HN21	sing	0.97Å	1.00Å
N2	HN22	sing	0.97Å	1.00Å
N3	HN3	sing	0.97Å	1.00Å
C8	H8	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
OP1	P	OP2	105.1°	109.5°
OP1	P	O3	108.2°	109.5°
OP1	P	OP3	110.3°	109.5°
O5	C6	C3A	118.3°	120.0°
O5	C6	N2	124.8°	120.0°
O6	C8	N3	127.7°	120.0°
O6	C8	H8	116.1°	120.0°
OP2	P	O3	107.2°	109.4°
OP2	P	OP3	112.7°	109.5°
P	OP2	HOP2	109.5°	113.9°
C3A	N1	C5	107.5°	109.2°
N1	C3A	C6	122.2°	126.4°
N1	C3A	C7A	108.3°	107.2°
N1	C5	N	109.4°	109.5°
N1	C5	H5	125.3°	125.2°
C3A	C6	N2	116.9°	120.0°
C6	C3A	C7A	129.6°	126.4°
C6	N2	HN21	109.3°	120.0°
C6	N2	HN22	125.3°	120.0°
P	O3	C4	117.8°	123.0°
O3	P	OP3	112.9°	109.5°
O3	C4	C	110.4°	109.4°
O3	C4	H41	109.1°	109.5°
O3	C4	H42	108.9°	109.5°
C3A	C7A	N	106.7°	106.4°
C3A	C7A	N3	127.3°	126.8°
C	O	C1	108.8°	105.3°
O	C	C4	104.0°	110.4°
O	C	C3	106.7°	104.8°
O	C	H	116.1°	110.5°
O	C1	N	100.9°	110.4°
O	C1	C2	106.5°	104.8°
O	C1	H1	116.9°	110.4°
P	OP3	HOP3	109.5°	114.0°
C5	N	C7A	108.1°	107.7°
C5	N	C1	124.3°	126.1°
N	C5	H5	125.3°	125.3°
C4	C	C3	113.4°	110.3°
C	C4	H41	109.2°	109.5°
C	C4	H42	108.9°	109.5°
C4	C	H	109.7°	110.4°
C8	N3	C7A	121.0°	120.0°
C8	N3	HN3	119.5°	120.1°
N3	C8	H8	116.2°	119.9°
N	C7A	N3	125.9°	126.8°
C7A	N	C1	127.6°	126.2°
C7A	N3	HN3	119.5°	120.0°
N	C1	C2	110.3°	110.4°
N	C1	H1	113.4°	110.4°
C	C3	C2	105.0°	104.1°
C	C3	O3'	108.0°	110.5°
C3	C	H	107.1°	110.4°
C	C3	H3	113.4°	110.5°
C1	C2	C3	104.2°	104.1°
C1	C2	O2'	107.9°	110.5°
C1	C2	H2	114.1°	110.6°
C2	C1	H1	108.5°	110.4°
C2	C3	O3'	109.9°	110.5°
C3	C2	O2'	110.3°	110.5°
C2	C3	H3	111.6°	110.5°
C3	C2	H2	111.8°	110.5°
O3'	C3	H3	108.8°	110.6°
C3	O3'	HO3'	109.5°	114.0°
O2'	C2	H2	108.4°	110.4°
C2	O2'	HO2'	109.5°	114.0°
H41	C4	H42	110.2°	109.5°
HN21	N2	HN22	125.3°	120.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OP1	P	OP2	O3	115.0°	120.0°
OP1	P	OP2	OP3	120.2°	120.0°
OP1	P	O3	OP3	122.4°	120.0°
OP1	P	O3	C4	62.6°	55.0°
OP1	P	OP2	HOP2	58.8°	60.0°
OP1	P	OP3	HOP3	9.8°	179.9°
O5	C6	C3A	N1	6.4°	180.0°
O5	C6	C3A	N2	179.5°	180.0°
O5	C6	C3A	C7A	174.1°	0.3°
O5	C6	N2	HN21	0.3°	180.0°
O5	C6	N2	HN22	179.7°	0.0°
O6	C8	N3	H8	180.0°	180.0°
O6	C8	N3	C7A	0.5°	5.2°
O6	C8	N3	HN3	179.4°	174.8°
OP2	P	O3	OP3	124.7°	120.0°
OP2	P	O3	C4	175.5°	175.0°
OP2	P	OP3	HOP3	127.0°	60.0°
N1	C3A	C6	C7A	179.5°	179.7°
N1	C3A	C6	N2	173.1°	0.0°
C3A	N1	C5	N	0.0°	0.0°
N1	C3A	C7A	N	0.1°	0.4°
N1	C3A	C7A	N3	178.6°	180.0°
C3A	N1	C5	H5	180.0°	180.0°
C5	N1	C3A	C6	179.6°	180.0°
C5	N1	C3A	C7A	0.1°	0.2°
N1	C5	N	H5	180.0°	180.0°
N1	C5	N	C7A	0.1°	0.3°
N1	C5	N	C1	179.1°	180.0°
C6	C3A	C7A	N	179.7°	179.8°
C6	C3A	C7A	N3	1.9°	0.3°
C3A	C6	N2	HN21	179.8°	0.0°
C3A	C6	N2	HN22	0.2°	180.0°
N2	C6	C3A	C7A	6.4°	179.7°
C6	N2	HN21	HN22	180.0°	180.0°
P	O3	C4	C	142.6°	180.0°
O3	P	OP2	HOP2	56.2°	180.0°
O3	P	OP3	HOP3	111.4°	59.9°
P	O3	C4	H41	22.6°	60.0°
P	O3	C4	H42	97.8°	60.0°
O3	C4	C	O	34.0°	69.7°
C4	O3	P	OP3	59.8°	65.0°
O3	C4	C	H41	120.0°	120.0°
O3	C4	C	H42	119.6°	120.0°
O3	C4	C	C3	81.6°	175.0°
O3	C4	H41	H42	119.6°	120.0°
O3	C4	C	H	158.7°	52.8°
C3A	C7A	N	C5	0.1°	0.4°
C3A	C7A	N3	C8	113.8°	118.3°
C3A	C7A	N	N3	178.5°	179.5°
C3A	C7A	N	C1	179.1°	179.9°
C3A	C7A	N3	HN3	66.3°	61.7°
O	C	C4	C3	115.6°	115.3°
O	C	C4	H	124.8°	122.4°
C	O	C1	N	146.3°	159.4°
O	C	C3	H	124.9°	119.0°
C	O	C1	C2	31.1°	40.6°
O	C	C3	C2	8.7°	24.0°
O	C	C3	O3'	126.0°	142.6°
O	C	C4	H41	154.0°	50.4°
O	C	C4	H42	85.6°	170.4°
O	C	C3	H3	113.4°	94.7°
C	O	C1	H1	90.2°	78.3°
O	C1	N	C5	34.8°	25.9°
C1	O	C	C4	145.1°	159.3°
O	C1	N	C7A	144.3°	154.4°
O	C1	N	C2	112.3°	115.3°
O	C1	N	H1	125.8°	122.4°
C1	O	C	C3	24.9°	40.6°
O	C1	C2	H1	126.6°	118.9°
O	C1	C2	C3	24.1°	24.0°
O	C1	C2	O2'	141.4°	142.6°
C1	O	C	H	94.4°	78.3°
O	C1	C2	H2	98.1°	94.7°
OP3	P	OP2	HOP2	179.0°	60.0°
C5	N	C7A	C1	179.2°	179.7°
C5	N	C7A	N3	178.6°	180.0°
C5	N	C1	C2	77.5°	89.4°
C5	N	C1	H1	160.6°	148.3°
C4	C	C3	H	121.1°	122.2°
C4	C	C3	C2	122.7°	142.8°
C4	C	C3	O3'	120.0°	98.6°
C	C4	H41	H42	119.6°	120.0°
C4	C	C3	H3	0.6°	24.1°
C8	N3	C7A	N	64.4°	61.1°
C8	N3	C7A	HN3	180.0°	180.0°
C7A	N	C1	C2	103.4°	90.2°
C7A	N	C1	H1	18.5°	32.1°
C7A	N	C5	H5	179.9°	179.7°
N	C7A	N3	HN3	115.6°	118.9°
N3	C7A	N	C1	0.6°	0.3°
C7A	N3	C8	H8	179.5°	174.8°
N	C1	C2	H1	124.8°	122.3°
N	C1	C2	C3	132.8°	142.8°
N	C1	C2	O2'	110.0°	98.5°
N	C1	C2	H2	10.5°	24.1°
C1	N	C5	H5	0.9°	0.0°
C	C3	C2	C1	9.1°	0.0°
C	C3	C2	O3'	116.0°	118.6°
C	C3	C2	H3	123.2°	118.6°
C	C3	O3'	H3	123.5°	122.7°
C	C3	C2	O2'	124.7°	118.6°
C3	C	C4	H41	38.4°	65.0°
C3	C	C4	H42	158.8°	55.0°
C	C3	O3'	HO3'	161.0°	180.0°
C	C3	C2	H2	114.6°	118.8°
C1	C2	C3	O2'	115.5°	118.6°
C1	C2	C3	H2	123.7°	118.8°
C1	C2	C3	O3'	106.9°	118.6°
C1	C2	O2'	H2	124.0°	122.7°
C1	C2	C3	H3	132.3°	118.6°
C1	C2	O2'	HO2'	152.4°	176.1°
C2	C3	O3'	H3	122.5°	122.7°
C3	C2	O2'	H2	122.8°	122.6°
C2	C3	C	H	116.2°	95.0°
C2	C3	O3'	HO3'	84.9°	65.3°
C3	C2	O2'	HO2'	94.4°	61.5°
C3	C2	C1	H1	102.4°	94.9°
O3'	C3	C2	O2'	8.7°	0.0°
O3'	C3	C	H	1.1°	23.7°
O3'	C3	C2	H2	129.4°	122.6°
O2'	C2	C3	H3	112.1°	122.7°
O2'	C2	C1	H1	14.8°	23.8°
H41	C4	C	H	81.3°	172.8°
H42	C4	C	H	39.1°	67.2°
H	C	C3	H3	121.7°	146.4°
H3	C3	O3'	HO3'	37.5°	57.4°
H3	C3	C2	H2	8.6°	0.1°
H2	C2	O2'	HO2'	28.4°	61.2°
H2	C2	C1	H1	135.3°	146.4°
HN3	N3	C8	H8	0.6°	5.2°

Definition date:	2007-09-12
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	2R7N