Obsolete: SCP

SCP was replaced with DCS on

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1	C2	doub	1.32Å	1.35Å	Aromatic
N1	C6	sing	1.32Å	1.35Å	Aromatic
C2	C2A	sing	1.51Å	1.50Å
C2	C3	sing	1.39Å	1.40Å	Aromatic
C2A	H2A1	sing	1.09Å	1.11Å
C2A	H2A2	sing	1.09Å	1.12Å
C2A	H2A3	sing	1.09Å	1.11Å
C3	O3	sing	1.36Å	1.38Å
C3	C4	doub	1.39Å	1.42Å	Aromatic
O3	HO3	sing	0.97Å	0.95Å
C4	C4A	sing	1.51Å	1.52Å
C4	C5	sing	1.38Å	1.41Å	Aromatic
C4A	N	sing	1.47Å	1.43Å
C4A	H4A1	sing	1.09Å	1.11Å
C4A	H4A2	sing	1.09Å	1.12Å
C5	C6	doub	1.38Å	1.40Å	Aromatic
C5	C5A	sing	1.51Å	1.51Å
C6	H6	sing	1.08Å	1.10Å
C5A	O4P	sing	1.43Å	1.42Å
C5A	H5A1	sing	1.09Å	1.11Å
C5A	H5A2	sing	1.09Å	1.12Å
O4P	P	sing	1.61Å	1.55Å
P	O1P	doub	1.48Å	1.48Å
P	O2P	sing	1.61Å	1.48Å
P	O3P	sing	1.61Å	1.50Å
O2P	HOP2	sing	0.97Å	0.95Å
O3P	HOP3	sing	0.97Å	0.95Å
N	CA	sing	1.47Å	1.32Å
N	HN	sing	1.01Å	1.02Å
CA	C	sing	1.52Å	1.46Å
CA	CB	sing	1.55Å	1.52Å
CA	HA	sing	1.09Å	1.12Å
C	O	doub	1.21Å	1.22Å
C	ND	sing	1.35Å	1.33Å
ND	OG	sing	1.41Å	1.41Å
ND	HND	sing	0.97Å	1.02Å
OG	CB	sing	1.44Å	1.42Å
CB	HB1	sing	1.09Å	1.11Å
CB	HB2	sing	1.09Å	1.11Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	N1	C6	117.9°	121.8°
N1	C2	C2A	116.1°	119.7°
N1	C2	C3	122.6°	120.7°
N1	C6	C5	123.6°	120.9°
N1	C6	H6	116.4°	119.5°
C2A	C2	C3	121.3°	119.6°
C2	C2A	H2A1	116.1°	109.5°
C2	C2A	H2A2	109.8°	109.5°
C2	C2A	H2A3	109.8°	109.5°
C2	C3	O3	118.3°	120.5°
C2	C3	C4	119.4°	119.0°
H2A1	C2A	H2A2	109.7°	109.5°
H2A1	C2A	H2A3	109.8°	109.5°
H2A2	C2A	H2A3	100.4°	109.5°
O3	C3	C4	122.2°	120.5°
C3	O3	HO3	118.3°	106.9°
C3	C4	C4A	123.0°	120.8°
C3	C4	C5	117.3°	118.4°
C4A	C4	C5	119.7°	120.8°
C4	C4A	N	113.6°	109.4°
C4	C4A	H4A1	110.7°	109.5°
C4	C4A	H4A2	110.7°	109.5°
C4	C5	C6	118.9°	119.2°
C4	C5	C5A	121.5°	120.4°
N	C4A	H4A1	110.7°	109.4°
N	C4A	H4A2	110.7°	109.5°
C4A	N	CA	125.1°	106.7°
C4A	N	HN	106.7°	106.7°
H4A1	C4A	H4A2	99.6°	109.5°
C6	C5	C5A	119.5°	120.4°
C5	C6	H6	120.0°	119.6°
C5	C5A	O4P	108.2°	109.4°
C5	C5A	H5A1	112.7°	109.4°
C5	C5A	H5A2	112.7°	109.4°
O4P	C5A	H5A1	112.7°	109.6°
O4P	C5A	H5A2	112.7°	109.4°
C5A	O4P	P	118.2°	106.8°
H5A1	C5A	H5A2	97.8°	109.5°
O4P	P	O1P	108.4°	109.5°
O4P	P	O2P	109.0°	109.5°
O4P	P	O3P	109.2°	109.5°
O1P	P	O2P	110.1°	109.4°
O1P	P	O3P	109.8°	109.5°
O2P	P	O3P	110.3°	109.5°
P	O2P	HOP2	109.1°	106.8°
P	O3P	HOP3	109.1°	106.8°
CA	N	HN	106.7°	106.7°
N	CA	C	125.7°	110.8°
N	CA	CB	129.5°	110.8°
N	CA	HA	11.8°	110.6°
C	CA	CB	104.7°	103.0°
C	CA	HA	136.0°	110.7°
CA	C	O	123.7°	126.4°
CA	C	ND	107.6°	107.4°
CB	CA	HA	119.0°	110.7°
CA	CB	OG	104.3°	102.6°
CA	CB	HB1	114.2°	110.8°
CA	CB	HB2	114.1°	110.8°
O	C	ND	128.6°	126.2°
C	ND	OG	112.3°	111.7°
C	ND	HND	121.3°	124.1°
OG	ND	HND	126.4°	124.2°
ND	OG	CB	108.3°	107.8°
OG	CB	HB1	114.2°	110.8°
OG	CB	HB2	114.2°	110.8°
HB1	CB	HB2	96.3°	110.8°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N1	C2	C2A	C3	179.9°	179.7°
N1	C2	C2A	H2A1	180.0°	90.0°
N1	C2	C2A	H2A2	54.8°	150.0°
N1	C2	C2A	H2A3	54.7°	30.0°
N1	C2	C3	O3	176.0°	180.0°
N1	C2	C3	C4	3.2°	0.6°
C2	N1	C6	C5	0.2°	0.0°
C2	N1	C6	H6	179.8°	180.0°
C6	N1	C2	C2A	176.3°	179.9°
C6	N1	C2	C3	3.6°	0.3°
N1	C6	C5	C4	4.3°	0.0°
N1	C6	C5	H6	180.0°	180.0°
N1	C6	C5	C5A	176.6°	180.0°
C2	C2A	H2A1	H2A2	125.2°	120.0°
C2	C2A	H2A1	H2A3	125.3°	120.0°
C2	C2A	H2A2	H2A3	115.6°	120.0°
C2A	C2	C3	O3	4.1°	0.3°
C2A	C2	C3	C4	176.7°	179.8°
C3	C2	C2A	H2A1	0.1°	90.4°
C3	C2	C2A	H2A2	125.4°	29.7°
C3	C2	C2A	H2A3	125.2°	149.7°
C2	C3	O3	C4	179.2°	179.5°
C2	C3	O3	HO3	180.0°	90.6°
C2	C3	C4	C4A	177.6°	179.7°
C2	C3	C4	C5	1.0°	0.5°
H2A1	C2A	H2A2	H2A3	115.6°	120.0°
O3	C3	C4	C4A	1.5°	0.2°
O3	C3	C4	C5	179.8°	180.0°
C4	C3	O3	HO3	0.8°	89.9°
C3	C4	C4A	C5	178.6°	179.8°
C3	C4	C4A	N	5.1°	89.7°
C3	C4	C4A	H4A1	130.4°	30.2°
C3	C4	C4A	H4A2	120.1°	150.2°
C3	C4	C5	C6	4.5°	0.3°
C3	C4	C5	C5A	176.4°	179.8°
C4	C4A	N	H4A1	125.3°	119.9°
C4	C4A	N	H4A2	125.3°	120.0°
C4	C4A	H4A1	H4A2	116.5°	120.0°
C4A	C4	C5	C6	174.2°	179.9°
C4A	C4	C5	C5A	4.9°	0.0°
C4	C4A	N	CA	163.9°	180.0°
C4	C4A	N	HN	38.6°	66.2°
C5	C4	C4A	N	176.3°	90.1°
C5	C4	C4A	H4A1	51.0°	150.0°
C5	C4	C4A	H4A2	58.5°	30.0°
C4	C5	C6	C5A	179.1°	180.0°
C4	C5	C6	H6	175.6°	180.0°
C4	C5	C5A	O4P	78.5°	180.0°
C4	C5	C5A	H5A1	46.7°	60.0°
C4	C5	C5A	H5A2	156.2°	60.1°
N	C4A	H4A1	H4A2	116.5°	120.1°
C4A	N	CA	HN	125.3°	113.8°
C4A	N	CA	C	178.5°	93.8°
C4A	N	CA	CB	0.1°	152.5°
C4A	N	CA	HA	28.4°	29.3°
H4A1	C4A	N	CA	38.6°	60.1°
H4A1	C4A	N	HN	86.7°	173.8°
H4A2	C4A	N	CA	70.9°	60.0°
H4A2	C4A	N	HN	163.8°	53.8°
C6	C5	C5A	O4P	100.5°	0.0°
C6	C5	C5A	H5A1	134.3°	120.1°
C6	C5	C5A	H5A2	24.7°	119.9°
C5A	C5	C6	H6	3.4°	0.0°
C5	C5A	O4P	H5A1	125.3°	120.0°
C5	C5A	O4P	H5A2	125.2°	119.9°
C5	C5A	H5A1	H5A2	118.6°	120.0°
C5	C5A	O4P	P	157.3°	180.0°
O4P	C5A	H5A1	H5A2	118.6°	120.0°
C5A	O4P	P	O1P	174.7°	60.1°
C5A	O4P	P	O2P	65.5°	180.0°
C5A	O4P	P	O3P	55.0°	59.9°
H5A1	C5A	O4P	P	32.0°	60.0°
H5A2	C5A	O4P	P	77.5°	60.1°
O4P	P	O1P	O2P	119.2°	120.0°
O4P	P	O1P	O3P	119.2°	120.0°
O4P	P	O2P	O3P	119.8°	120.0°
O4P	P	O2P	HOP2	180.0°	180.0°
O4P	P	O3P	HOP3	180.0°	60.0°
O1P	P	O2P	O3P	121.3°	120.0°
O1P	P	O2P	HOP2	61.1°	60.0°
O1P	P	O3P	HOP3	61.2°	180.0°
O2P	P	O3P	HOP3	60.2°	60.0°
O3P	P	O2P	HOP2	60.2°	60.0°
N	CA	C	CB	178.8°	118.5°
N	CA	C	HA	7.6°	123.1°
N	CA	CB	HA	6.4°	123.2°
N	CA	C	O	15.8°	46.2°
N	CA	C	ND	161.8°	133.5°
N	CA	CB	OG	164.6°	143.5°
N	CA	CB	HB1	39.3°	25.2°
N	CA	CB	HB2	70.1°	98.2°
HN	N	CA	C	53.2°	20.0°
HN	N	CA	CB	125.2°	93.7°
HN	N	CA	HA	153.7°	143.1°
C	CA	CB	HA	174.9°	118.3°
CA	C	O	ND	177.1°	179.7°
CA	C	ND	OG	13.6°	1.5°
CA	C	ND	HND	166.4°	178.7°
C	CA	CB	OG	14.1°	25.0°
C	CA	CB	HB1	139.4°	93.3°
C	CA	CB	HB2	111.2°	143.3°
CB	CA	C	O	165.4°	164.8°
CB	CA	C	ND	17.0°	14.9°
CA	CB	OG	ND	6.7°	26.9°
CA	CB	OG	HB1	125.3°	118.2°
CA	CB	OG	HB2	125.2°	118.3°
CA	CB	HB1	HB2	120.0°	123.4°
HA	CA	C	O	8.1°	76.8°
HA	CA	C	ND	169.5°	103.4°
HA	CA	CB	OG	171.0°	93.3°
HA	CA	CB	HB1	45.7°	148.4°
HA	CA	CB	HB2	63.7°	25.0°
O	C	ND	OG	168.9°	178.8°
O	C	ND	HND	11.1°	1.1°
C	ND	OG	HND	180.0°	179.9°
C	ND	OG	CB	4.2°	18.9°
ND	OG	CB	HB1	132.0°	91.4°
ND	OG	CB	HB2	118.6°	145.2°
HND	ND	OG	CB	175.8°	161.2°
OG	CB	HB1	HB2	120.1°	123.4°

Definition date:	1999-07-08
Last modified:	2008-10-14
Release status:	OBS
Processing site:	RCSB
Replaced by:	DCS
Derived from:	2DAA