LEC

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C8	C7	sing	1.51Å	1.52Å
C7	O7	doub	1.21Å	1.25Å
C7	N2	sing	1.35Å	1.34Å
N2	C2	sing	1.46Å	1.48Å
C2	C3	sing	1.53Å	1.55Å
C2	C1	sing	1.53Å	1.55Å
C3	O3	sing	1.43Å	1.44Å
C3	C4	sing	1.53Å	1.55Å
C4	O4	sing	1.43Å	1.44Å
C4	C5	sing	1.53Å	1.54Å
C5	C6	sing	1.53Å	1.56Å
C5	O5	sing	1.43Å	1.46Å
C6	O6	sing	1.43Å	1.43Å
O5	C1	sing	1.43Å	1.47Å
C1	O1	sing	1.43Å	1.45Å
O1	C1'	sing	1.36Å	1.38Å
C1'	C2'	doub	1.39Å	1.39Å	Aromatic
C1'	C6'	sing	1.39Å	1.39Å	Aromatic
C2'	C3'	sing	1.38Å	1.40Å	Aromatic
C3'	C4'	doub	1.38Å	1.39Å	Aromatic
C4'	N1'	sing	1.48Å	1.35Å
C4'	C5'	sing	1.38Å	1.39Å	Aromatic
N1'	O2'	sing	1.22Å	1.40Å
N1'	O1'	doub	1.22Å	1.39Å
C5'	C6'	doub	1.38Å	1.39Å	Aromatic
C8	H81	sing	1.09Å	1.10Å
C8	H82	sing	1.09Å	1.10Å
C8	H83	sing	1.09Å	1.10Å
N2	HN2	sing	0.97Å	1.00Å
C2	H2	sing	1.09Å	1.10Å
C3	H3	sing	1.09Å	1.10Å
O3	HO3	sing	0.97Å	0.95Å
C4	H4	sing	1.09Å	1.10Å
O4	HO4	sing	0.97Å	0.95Å
C5	H5	sing	1.09Å	1.10Å
C6	H61	sing	1.09Å	1.10Å
C6	H62	sing	1.09Å	1.10Å
O6	HO6	sing	0.97Å	0.95Å
C1	H1	sing	1.09Å	1.10Å
C2'	H2'	sing	1.08Å	1.08Å
C3'	H3'	sing	1.08Å	1.08Å
C5'	H5'	sing	1.08Å	1.08Å
C6'	H6'	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C8	C7	O7	120.9°	120.0°
C8	C7	N2	114.4°	120.0°
C7	C8	H81	109.5°	109.4°
C7	C8	H82	109.5°	109.5°
C7	C8	H83	109.5°	109.5°
O7	C7	N2	124.7°	120.0°
C7	N2	C2	124.7°	120.0°
C7	N2	HN2	117.6°	120.0°
N2	C2	C3	109.8°	109.6°
N2	C2	C1	108.5°	109.5°
C2	N2	HN2	117.6°	120.0°
N2	C2	H2	111.2°	109.5°
C3	C2	C1	112.8°	109.1°
C2	C3	O3	109.8°	109.5°
C2	C3	C4	113.3°	109.1°
C3	C2	H2	106.6°	109.6°
C2	C3	H3	106.9°	109.6°
C2	C1	O5	114.6°	109.4°
C2	C1	O1	106.0°	109.5°
C1	C2	H2	108.0°	109.5°
C2	C1	H1	108.0°	109.5°
O3	C3	C4	110.4°	109.6°
O3	C3	H3	110.1°	109.5°
C3	O3	HO3	109.5°	114.0°
C3	C4	O4	110.2°	109.5°
C3	C4	C5	111.5°	109.1°
C4	C3	H3	106.3°	109.6°
C3	C4	H4	107.8°	109.5°
O4	C4	C5	110.1°	109.5°
O4	C4	H4	109.3°	109.5°
C4	O4	HO4	109.5°	114.0°
C4	C5	C6	112.7°	109.4°
C4	C5	O5	111.7°	109.4°
C5	C4	H4	107.9°	109.6°
C4	C5	H5	105.6°	109.5°
C6	C5	O5	109.4°	109.5°
C5	C6	O6	110.7°	109.4°
C6	C5	H5	108.1°	109.5°
C5	C6	H61	109.1°	109.5°
C5	C6	H62	108.8°	109.5°
C5	O5	C1	114.3°	114.1°
O5	C5	H5	109.1°	109.5°
O6	C6	H61	109.1°	109.4°
O6	C6	H62	108.8°	109.5°
C6	O6	HO6	109.5°	113.9°
O5	C1	O1	108.1°	109.5°
O5	C1	H1	105.9°	109.5°
C1	O1	C1'	119.5°	117.0°
O1	C1	H1	114.5°	109.4°
O1	C1'	C2'	122.3°	120.1°
O1	C1'	C6'	119.5°	120.0°
C2'	C1'	C6'	118.2°	119.9°
C1'	C2'	C3'	121.7°	119.9°
C1'	C2'	H2'	119.2°	120.0°
C1'	C6'	C5'	120.4°	119.9°
C1'	C6'	H6'	119.8°	120.0°
C2'	C3'	C4'	119.7°	120.1°
C3'	C2'	H2'	119.2°	120.1°
C2'	C3'	H3'	120.2°	120.0°
C3'	C4'	N1'	122.1°	120.0°
C3'	C4'	C5'	118.5°	120.1°
C4'	C3'	H3'	120.1°	120.0°
N1'	C4'	C5'	119.4°	119.9°
C4'	N1'	O2'	123.0°	120.0°
C4'	N1'	O1'	119.1°	120.0°
C4'	C5'	C6'	121.5°	120.0°
C4'	C5'	H5'	119.2°	120.0°
O2'	N1'	O1'	117.9°	120.0°
C6'	C5'	H5'	119.3°	120.0°
C5'	C6'	H6'	119.8°	120.0°
H81	C8	H82	109.5°	109.5°
H81	C8	H83	109.5°	109.5°
H82	C8	H83	109.5°	109.5°
H61	C6	H62	110.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C8	C7	O7	N2	177.8°	180.0°
C8	C7	N2	C2	1.4°	180.0°
C7	C8	H81	H82	120.0°	120.0°
C7	C8	H81	H83	120.0°	120.0°
C7	C8	H82	H83	120.0°	120.0°
C8	C7	N2	HN2	178.6°	0.0°
O7	C7	N2	C2	179.4°	0.1°
O7	C7	C8	H81	41.4°	0.0°
O7	C7	C8	H82	78.6°	120.0°
O7	C7	C8	H83	161.4°	120.0°
O7	C7	N2	HN2	0.6°	180.0°
C7	N2	C2	HN2	180.0°	179.9°
C7	N2	C2	C3	126.4°	155.0°
C7	N2	C2	C1	109.9°	85.3°
N2	C7	C8	H81	136.6°	180.0°
N2	C7	C8	H82	103.4°	60.0°
N2	C7	C8	H83	16.6°	60.0°
C7	N2	C2	H2	8.7°	34.8°
N2	C2	C3	C1	121.1°	119.9°
N2	C2	C3	H2	120.5°	120.2°
N2	C2	C1	H2	120.6°	120.1°
N2	C2	C3	O3	72.7°	63.2°
N2	C2	C3	C4	163.4°	176.9°
N2	C2	C1	O5	165.1°	177.5°
N2	C2	C1	O1	75.8°	62.5°
N2	C2	C3	H3	46.6°	56.9°
N2	C2	C1	H1	47.3°	57.5°
C3	C2	C1	H2	117.6°	119.9°
C2	C3	O3	C4	125.5°	119.6°
C2	C3	O3	H3	117.4°	120.2°
C2	C3	C4	H3	117.1°	120.0°
C2	C3	C4	O4	170.8°	176.9°
C2	C3	C4	C5	48.2°	57.0°
C3	C2	C1	O5	43.3°	57.6°
C3	C2	C1	O1	162.4°	177.6°
C3	C2	N2	HN2	53.6°	24.9°
C2	C3	O3	HO3	94.0°	180.0°
C2	C3	C4	H4	70.0°	63.0°
C3	C2	C1	H1	74.5°	62.4°
C1	C2	C3	O3	166.2°	176.9°
C1	C2	C3	C4	42.3°	57.0°
C2	C1	O5	C5	51.5°	61.2°
C2	C1	O5	O1	117.9°	120.0°
C2	C1	O5	H1	119.0°	120.0°
C2	C1	O1	H1	119.0°	120.0°
C2	C1	O1	C1'	167.4°	175.0°
C1	C2	N2	HN2	70.1°	94.7°
C1	C2	C3	H3	74.5°	63.0°
O3	C3	C4	H3	119.3°	120.2°
O3	C3	C4	O4	65.6°	63.2°
O3	C3	C4	C5	171.8°	176.9°
O3	C3	C2	H2	47.8°	57.0°
O3	C3	C4	H4	53.5°	56.9°
C3	C4	O4	C5	123.4°	119.7°
C3	C4	O4	H4	118.3°	120.1°
C3	C4	C5	H4	118.2°	119.9°
C3	C4	C5	C6	178.6°	177.6°
C3	C4	C5	O5	55.0°	57.6°
C4	C3	C2	H2	76.1°	62.9°
C4	C3	O3	HO3	140.5°	60.4°
C3	C4	O4	HO4	166.3°	180.0°
C3	C4	C5	H5	63.6°	62.4°
O4	C4	C5	H4	119.2°	120.2°
O4	C4	C5	C6	58.7°	62.5°
O4	C4	C5	O5	177.6°	177.5°
O4	C4	C3	H3	53.7°	56.9°
O4	C4	C5	H5	59.1°	57.5°
C4	C5	C6	O5	125.0°	119.9°
C4	C5	C6	H5	116.3°	120.0°
C4	C5	O5	H5	116.4°	120.0°
C4	C5	C6	O6	68.6°	175.0°
C4	C5	O5	C1	57.1°	61.2°
C5	C4	C3	H3	68.9°	63.0°
C5	C4	O4	HO4	70.3°	60.4°
C4	C5	C6	H61	171.4°	55.1°
C4	C5	C6	H62	50.9°	65.0°
C6	C5	O5	H5	118.1°	120.1°
C5	C6	O6	H61	120.0°	120.0°
C5	C6	O6	H62	119.5°	120.0°
C6	C5	O5	C1	177.4°	178.9°
C6	C5	C4	H4	60.5°	57.7°
C5	C6	H61	H62	119.5°	120.1°
C5	C6	O6	HO6	36.5°	179.9°
O5	C5	C6	O6	56.4°	65.1°
C5	O5	C1	O1	169.4°	178.8°
O5	C5	C4	H4	63.2°	62.3°
O5	C5	C6	H61	63.6°	175.0°
O5	C5	C6	H62	175.9°	54.9°
C5	O5	C1	H1	67.5°	58.8°
O6	C6	C5	H5	175.1°	55.0°
O6	C6	H61	H62	119.5°	120.0°
O5	C1	O1	H1	117.8°	120.0°
O5	C1	O1	C1'	69.4°	65.0°
O5	C1	C2	H2	74.3°	62.3°
C1	O5	C5	H5	59.3°	58.8°
C1	O1	C1'	C2'	47.6°	180.0°
C1	O1	C1'	C6'	135.0°	0.3°
O1	C1	C2	H2	44.8°	57.7°
O1	C1'	C2'	C6'	177.4°	179.7°
O1	C1'	C2'	C3'	178.4°	180.0°
O1	C1'	C6'	C5'	178.6°	179.8°
C1'	O1	C1	H1	48.4°	55.0°
O1	C1'	C2'	H2'	1.6°	0.1°
O1	C1'	C6'	H6'	1.4°	0.1°
C1'	C2'	C3'	H2'	180.0°	179.9°
C1'	C2'	C3'	C4'	0.7°	0.1°
C2'	C1'	C6'	C5'	1.1°	0.5°
C1'	C2'	C3'	H3'	179.3°	180.0°
C2'	C1'	C6'	H6'	178.9°	179.7°
C6'	C1'	C2'	C3'	1.0°	0.3°
C1'	C6'	C5'	C4'	1.0°	0.5°
C1'	C6'	C5'	H6'	180.0°	179.7°
C6'	C1'	C2'	H2'	179.0°	179.8°
C1'	C6'	C5'	H5'	179.0°	179.7°
C2'	C3'	C4'	H3'	180.0°	180.0°
C2'	C3'	C4'	N1'	179.7°	179.9°
C2'	C3'	C4'	C5'	0.4°	0.0°
C3'	C4'	N1'	C5'	179.3°	180.0°
C3'	C4'	N1'	O2'	6.5°	0.0°
C3'	C4'	N1'	O1'	175.1°	179.9°
C3'	C4'	C5'	C6'	0.6°	0.3°
C4'	C3'	C2'	H2'	179.3°	180.0°
C3'	C4'	C5'	H5'	179.4°	179.9°
C4'	N1'	O2'	O1'	178.5°	179.9°
N1'	C4'	C5'	C6'	179.9°	179.7°
N1'	C4'	C3'	H3'	0.2°	0.1°
N1'	C4'	C5'	H5'	0.1°	0.1°
C5'	C4'	N1'	O2'	172.8°	180.0°
C5'	C4'	N1'	O1'	5.6°	0.1°
C4'	C5'	C6'	H5'	180.0°	179.8°
C5'	C4'	C3'	H3'	179.5°	180.0°
C4'	C5'	C6'	H6'	179.0°	179.8°
H81	C8	H82	H83	120.0°	120.0°
HN2	N2	C2	H2	171.3°	145.1°
H2	C2	C3	H3	167.2°	177.1°
H2	C2	C1	H1	167.9°	177.7°
H3	C3	O3	HO3	23.4°	59.9°
H3	C3	C4	H4	172.9°	177.0°
H4	C4	O4	HO4	48.1°	59.9°
H4	C4	C5	H5	178.3°	177.7°
H5	C5	C6	H61	55.1°	64.9°
H5	C5	C6	H62	65.4°	175.0°
H61	C6	O6	HO6	156.5°	59.9°
H62	C6	O6	HO6	83.0°	60.0°
H2'	C2'	C3'	H3'	0.7°	0.0°
H5'	C5'	C6'	H6'	1.0°	0.1°

Definition date:	2008-11-07
Last modified:	2020-07-17
Release status:	REL
Processing site:	PDBJ
Derived from:	3F64