Obsolete: NAN

NAN was replaced with SIA on

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.51Å	1.54Å
C1	O1A	doub	1.21Å	1.22Å
C1	O1B	sing	1.34Å	1.22Å
C2	C3	sing	1.53Å	1.52Å
C2	O2	sing	1.43Å	1.44Å
C2	O6	sing	1.43Å	1.43Å
C3	C4	sing	1.53Å	1.54Å
C3	H31	sing	1.09Å	1.09Å
C3	H32	sing	1.09Å	1.10Å
C4	C5	sing	1.53Å	1.53Å
C4	O4	sing	1.43Å	1.43Å
C4	H4	sing	1.09Å	1.11Å
C5	C6	sing	1.53Å	1.55Å
C5	N5	sing	1.46Å	1.45Å
C5	H5	sing	1.09Å	1.10Å
C6	C7	sing	1.53Å	1.52Å
C6	O6	sing	1.43Å	1.43Å
C6	H6	sing	1.09Å	1.10Å
C7	C8	sing	1.53Å	1.53Å
C7	O7	sing	1.43Å	1.40Å
C7	H7	sing	1.09Å	1.10Å
C8	C9	sing	1.53Å	1.53Å
C8	O8	sing	1.43Å	1.40Å
C8	H8	sing	1.09Å	1.10Å
C9	O9	sing	1.43Å	1.41Å
C9	H91	sing	1.09Å	1.10Å
C9	H92	sing	1.09Å	1.10Å
C10	C11	sing	1.51Å	1.51Å
C10	N5	sing	1.35Å	1.32Å
C10	O10	doub	1.21Å	1.22Å
C11	H111	sing	1.09Å	1.10Å
C11	H112	sing	1.09Å	1.10Å
C11	H113	sing	1.09Å	1.10Å
N5	HN5	sing	0.97Å	0.97Å
O1B	HOB1	sing	0.97Å	0.95Å
O2	HO2	sing	0.97Å	0.95Å
O4	HO4	sing	0.97Å	0.96Å
O7	HO7	sing	0.97Å	0.96Å
O8	HO8	sing	0.97Å	0.97Å
O9	HO9	sing	0.97Å	0.97Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	O1A	120.0°	120.0°
C2	C1	O1B	120.5°	120.0°
C1	C2	C3	110.4°	109.4°
C1	C2	O2	107.3°	109.4°
C1	C2	O6	112.4°	109.4°
O1A	C1	O1B	119.5°	120.0°
C1	O1B	HOB1	120.5°	120.0°
C3	C2	O2	110.2°	109.4°
C3	C2	O6	108.1°	109.8°
C2	C3	C4	110.9°	109.0°
C2	C3	H31	110.1°	109.5°
C2	C3	H32	108.9°	109.5°
O2	C2	O6	108.3°	109.5°
C2	O2	HO2	107.3°	106.7°
C2	O6	C6	118.9°	107.7°
C4	C3	H31	111.4°	109.6°
C4	C3	H32	109.9°	109.5°
C3	C4	C5	108.6°	108.6°
C3	C4	O4	113.8°	109.7°
C3	C4	H4	109.0°	109.6°
H31	C3	H32	105.5°	109.7°
C5	C4	O4	109.9°	109.7°
C5	C4	H4	109.5°	109.6°
C4	C5	C6	106.9°	109.1°
C4	C5	N5	105.5°	109.5°
C4	C5	H5	109.4°	109.5°
O4	C4	H4	106.0°	109.6°
C4	O4	HO4	108.7°	106.8°
C6	C5	N5	114.7°	109.6°
C6	C5	H5	109.8°	109.6°
C5	C6	C7	115.2°	109.5°
C5	C6	O6	109.4°	109.8°
C5	C6	H6	108.5°	109.4°
N5	C5	H5	110.4°	109.5°
C5	N5	C10	123.2°	120.1°
C5	N5	HN5	115.9°	119.9°
C7	C6	O6	106.1°	109.4°
C7	C6	H6	107.3°	109.4°
C6	C7	C8	112.9°	109.5°
C6	C7	O7	107.2°	109.5°
C6	C7	H7	110.2°	109.5°
O6	C6	H6	110.4°	109.4°
C8	C7	O7	107.5°	109.5°
C8	C7	H7	108.4°	109.5°
C7	C8	C9	111.9°	109.5°
C7	C8	O8	112.3°	109.5°
C7	C8	H8	108.3°	109.4°
O7	C7	H7	110.6°	109.4°
C7	O7	HO7	105.8°	106.8°
C9	C8	O8	107.5°	109.5°
C9	C8	H8	109.0°	109.4°
C8	C9	O9	106.4°	109.5°
C8	C9	H91	111.5°	109.5°
C8	C9	H92	108.7°	109.5°
O8	C8	H8	107.8°	109.5°
C8	O8	HO8	108.0°	106.8°
O9	C9	H91	110.5°	109.5°
O9	C9	H92	111.9°	109.5°
C9	O9	HO9	106.7°	106.8°
H91	C9	H92	107.9°	109.4°
C11	C10	N5	120.6°	120.0°
C11	C10	O10	119.6°	120.0°
C10	C11	H111	110.7°	109.5°
C10	C11	H112	109.9°	109.5°
C10	C11	H113	109.6°	109.5°
N5	C10	O10	119.8°	120.0°
C10	N5	HN5	120.5°	120.0°
H111	C11	H112	109.2°	109.5°
H111	C11	H113	108.3°	109.5°
H112	C11	H113	109.2°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	O1A	O1B	178.8°	179.9°
C1	C2	C3	O2	118.4°	119.8°
C1	C2	C3	O6	123.3°	120.0°
C1	C2	O2	O6	121.6°	119.9°
C1	C2	C3	C4	69.7°	58.8°
C1	C2	C3	H31	54.1°	61.0°
C1	C2	C3	H32	169.3°	178.7°
C1	C2	O6	C6	67.9°	52.5°
C2	C1	O1B	HOB1	180.0°	180.0°
C1	C2	O2	HO2	179.9°	60.2°
O1A	C1	C2	C3	42.0°	143.2°
O1A	C1	C2	O2	78.1°	97.0°
O1A	C1	C2	O6	162.9°	22.9°
O1A	C1	O1B	HOB1	1.2°	0.0°
O1B	C1	C2	C3	139.2°	36.7°
O1B	C1	C2	O2	100.6°	83.0°
O1B	C1	C2	O6	18.3°	157.0°
C3	C2	O2	O6	118.1°	120.3°
C2	C3	C4	H31	123.0°	119.8°
C2	C3	C4	H32	120.4°	119.8°
C2	C3	H31	H32	117.3°	120.2°
C2	C3	C4	C5	60.8°	53.7°
C2	C3	C4	O4	176.5°	173.6°
C2	C3	C4	H4	58.4°	66.0°
C3	C2	O6	C6	54.2°	67.5°
C3	C2	O2	HO2	59.8°	180.0°
O2	C2	C3	C4	171.8°	178.6°
O2	C2	C3	H31	64.4°	58.8°
O2	C2	C3	H32	50.8°	61.5°
O2	C2	O6	C6	173.7°	172.4°
O6	C2	C3	C4	53.6°	61.2°
O6	C2	C3	H31	177.4°	178.9°
O6	C2	C3	H32	67.4°	58.6°
C2	O6	C6	C5	57.2°	67.5°
C2	O6	C6	C7	178.0°	172.3°
C2	O6	C6	H6	62.1°	52.6°
O6	C2	O2	HO2	58.4°	59.7°
C4	C3	H31	H32	119.2°	120.3°
C3	C4	C5	O4	125.0°	119.9°
C3	C4	C5	H4	118.9°	119.7°
C3	C4	O4	H4	119.8°	120.4°
C3	C4	C5	C6	60.8°	53.7°
C3	C4	C5	N5	176.7°	173.6°
C3	C4	C5	H5	58.0°	66.2°
C3	C4	O4	HO4	43.1°	60.8°
H31	C3	C4	C5	176.1°	173.5°
H31	C3	C4	O4	53.4°	66.6°
H31	C3	C4	H4	64.6°	53.8°
H32	C3	C4	C5	59.6°	66.1°
H32	C3	C4	O4	63.1°	53.7°
H32	C3	C4	H4	178.8°	174.1°
C5	C4	O4	H4	118.2°	120.4°
C4	C5	C6	N5	116.5°	119.9°
C4	C5	C6	H5	118.5°	119.9°
C4	C5	N5	H5	118.0°	120.1°
C4	C5	C6	C7	176.7°	178.8°
C4	C5	C6	O6	57.4°	61.2°
C4	C5	C6	H6	63.1°	58.9°
C4	C5	N5	C10	154.2°	90.1°
C4	C5	N5	HN5	19.1°	89.8°
C5	C4	O4	HO4	165.1°	180.0°
O4	C4	C5	C6	174.2°	173.6°
O4	C4	C5	N5	51.7°	66.5°
O4	C4	C5	H5	67.0°	53.7°
H4	C4	C5	C6	58.1°	66.0°
H4	C4	C5	N5	64.3°	53.9°
H4	C4	C5	H5	177.0°	174.1°
H4	C4	O4	HO4	76.7°	59.6°
C6	C5	N5	H5	124.6°	120.2°
C5	C6	C7	O6	121.1°	120.4°
C5	C6	C7	H6	120.8°	119.9°
C5	C6	O6	H6	119.3°	120.0°
C5	C6	C7	C8	178.6°	179.6°
C5	C6	C7	O7	63.2°	60.3°
C5	C6	C7	H7	57.2°	59.6°
C6	C5	N5	C10	88.5°	150.2°
C6	C5	N5	HN5	98.2°	29.8°
N5	C5	C6	C7	66.8°	58.9°
N5	C5	C6	O6	173.9°	178.9°
N5	C5	C6	H6	53.4°	61.0°
C5	N5	C10	C11	178.8°	180.0°
C5	N5	C10	HN5	173.0°	180.0°
C5	N5	C10	O10	4.3°	0.0°
H5	C5	C6	C7	58.1°	61.3°
H5	C5	C6	O6	61.2°	58.8°
H5	C5	C6	H6	178.3°	178.8°
H5	C5	N5	C10	36.1°	30.0°
H5	C5	N5	HN5	137.2°	150.0°
C7	C6	O6	H6	115.9°	119.8°
C6	C7	C8	O7	118.0°	120.0°
C6	C7	C8	H7	122.4°	120.0°
C6	C7	O7	H7	120.2°	120.0°
C6	C7	C8	C9	175.5°	180.0°
C6	C7	C8	O8	54.5°	60.0°
C6	C7	C8	H8	64.3°	60.1°
C6	C7	O7	HO7	44.4°	60.0°
O6	C6	C7	C8	60.3°	60.0°
O6	C6	C7	O7	57.9°	60.0°
O6	C6	C7	H7	178.4°	179.9°
H6	C6	C7	C8	57.8°	59.8°
H6	C6	C7	O7	175.9°	179.8°
H6	C6	C7	H7	63.6°	60.3°
C8	C7	O7	H7	118.2°	120.0°
C7	C8	C9	O8	123.7°	120.0°
C7	C8	C9	H8	119.7°	120.0°
C7	C8	O8	H8	119.2°	120.0°
C7	C8	C9	O9	163.3°	180.0°
C7	C8	C9	H91	42.7°	60.0°
C7	C8	C9	H92	76.0°	60.0°
C8	C7	O7	HO7	77.2°	60.0°
C7	C8	O8	HO8	115.9°	60.0°
O7	C7	C8	C9	66.5°	60.0°
O7	C7	C8	O8	172.6°	180.0°
O7	C7	C8	H8	53.7°	60.0°
H7	C7	C8	C9	53.1°	59.9°
H7	C7	C8	O8	67.9°	60.1°
H7	C7	C8	H8	173.3°	179.9°
H7	C7	O7	HO7	164.7°	180.0°
C9	C8	O8	H8	117.4°	120.0°
C8	C9	O9	H91	121.2°	120.0°
C8	C9	O9	H92	118.5°	120.0°
C8	C9	H91	H92	119.2°	120.0°
C9	C8	O8	HO8	7.5°	60.0°
C8	C9	O9	HO9	28.4°	180.0°
O8	C8	C9	O9	39.7°	60.0°
O8	C8	C9	H91	80.9°	180.0°
O8	C8	C9	H92	160.3°	60.1°
H8	C8	C9	O9	76.9°	60.0°
H8	C8	C9	H91	162.5°	60.0°
H8	C8	C9	H92	43.7°	179.9°
H8	C8	O8	HO8	124.9°	180.0°
O9	C9	H91	H92	122.6°	120.0°
H91	C9	O9	HO9	149.6°	60.0°
H92	C9	O9	HO9	90.2°	60.0°
C11	C10	N5	O10	176.9°	180.0°
C10	C11	H111	H112	121.1°	120.0°
C10	C11	H111	H113	120.2°	120.0°
C10	C11	H112	H113	120.3°	120.0°
C11	C10	N5	HN5	5.8°	0.0°
N5	C10	C11	H111	31.8°	180.0°
N5	C10	C11	H112	88.9°	60.0°
N5	C10	C11	H113	151.2°	60.0°
O10	C10	C11	H111	145.1°	0.0°
O10	C10	C11	H112	94.2°	120.0°
O10	C10	C11	H113	25.7°	120.0°
O10	C10	N5	HN5	177.3°	180.0°
H111	C11	H112	H113	118.2°	120.0°

Definition date:	1999-07-08
Last modified:	2008-10-14
Release status:	OBS
Processing site:	RCSB
Replaced by:	SIA
Derived from:	1HGG