MDR

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C6'	C6	sing	1.51Å	1.50Å
C6'	H6'1	sing	1.09Å	1.11Å
C6'	H6'2	sing	1.09Å	1.12Å
C6'	H6'3	sing	1.09Å	1.12Å
C6	N1	doub	1.32Å	1.40Å	Aromatic
C6	C5	sing	1.39Å	1.41Å	Aromatic
N1	C2	sing	1.32Å	1.36Å	Aromatic
C2	N3	doub	1.32Å	1.36Å	Aromatic
C2	H2	sing	1.08Å	1.10Å
N3	C4	sing	1.33Å	1.41Å	Aromatic
C4	C5	doub	1.41Å	1.40Å	Aromatic
C4	N9	sing	1.37Å	1.41Å	Aromatic
C5	N7	sing	1.36Å	1.39Å	Aromatic
N7	C8	doub	1.30Å	1.30Å	Aromatic
C8	N9	sing	1.36Å	1.35Å	Aromatic
C8	H8	sing	1.08Å	1.10Å
N9	C1'	sing	1.46Å	1.47Å
C1'	C2'	sing	1.54Å	1.53Å
C1'	O4'	sing	1.44Å	1.48Å
C1'	H1'	sing	1.09Å	1.11Å
C2'	C3'	sing	1.55Å	1.49Å
C2'	H2'1	sing	1.09Å	1.11Å
C2'	H2'2	sing	1.09Å	1.12Å
C3'	O3'	sing	1.43Å	1.43Å
C3'	C4'	sing	1.55Å	1.51Å
C3'	H3'	sing	1.09Å	1.12Å
O3'	H1	sing	0.97Å	0.95Å
C4'	C5'	sing	1.53Å	1.55Å
C4'	O4'	sing	1.45Å	1.45Å
C4'	H4'	sing	1.09Å	1.11Å
C5'	O5'	sing	1.43Å	1.44Å
C5'	H5'1	sing	1.09Å	1.12Å
C5'	H5'2	sing	1.09Å	1.12Å
O5'	H5'	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C6	C6'	H6'1	124.1°	109.5°
C6	C6'	H6'2	107.1°	109.5°
C6	C6'	H6'3	107.0°	109.5°
C6'	C6	N1	124.0°	120.7°
C6'	C6	C5	116.4°	120.7°
H6'1	C6'	H6'2	107.0°	109.5°
H6'1	C6'	H6'3	107.1°	109.4°
H6'2	C6'	H6'3	102.6°	109.5°
N1	C6	C5	119.6°	118.6°
C6	N1	C2	120.6°	121.3°
C6	C5	C4	115.7°	118.3°
C6	C5	N7	132.6°	134.8°
N1	C2	N3	124.2°	122.4°
N1	C2	H2	118.0°	118.8°
N3	C2	H2	117.8°	118.8°
C2	N3	C4	114.0°	120.5°
N3	C4	C5	125.9°	119.0°
N3	C4	N9	129.9°	135.0°
C5	C4	N9	104.1°	106.0°
C4	C5	N7	111.7°	107.0°
C4	N9	C8	104.8°	107.4°
C4	N9	C1'	133.6°	126.3°
C5	N7	C8	102.3°	109.5°
N7	C8	N9	117.1°	110.1°
N7	C8	H8	119.6°	124.9°
N9	C8	H8	123.2°	125.0°
C8	N9	C1'	121.6°	126.3°
N9	C1'	C2'	121.5°	109.9°
N9	C1'	O4'	108.6°	109.9°
N9	C1'	H1'	99.9°	109.9°
C2'	C1'	O4'	103.4°	107.4°
C2'	C1'	H1'	105.4°	109.9°
C1'	C2'	C3'	105.3°	104.2°
C1'	C2'	H2'1	113.8°	110.5°
C1'	C2'	H2'2	113.8°	110.5°
O4'	C1'	H1'	119.1°	109.9°
C1'	O4'	C4'	108.7°	106.9°
C3'	C2'	H2'1	113.8°	110.5°
C3'	C2'	H2'2	113.8°	110.4°
C2'	C3'	O3'	108.6°	110.9°
C2'	C3'	C4'	101.0°	102.1°
C2'	C3'	H3'	117.4°	110.9°
H2'1	C2'	H2'2	96.7°	110.6°
O3'	C3'	C4'	114.9°	110.9°
O3'	C3'	H3'	104.1°	110.8°
C3'	O3'	H1	108.5°	106.8°
C4'	C3'	H3'	111.3°	110.9°
C3'	C4'	C5'	111.4°	110.6°
C3'	C4'	O4'	107.2°	103.5°
C3'	C4'	H4'	110.7°	110.6°
C5'	C4'	O4'	112.1°	110.8°
C5'	C4'	H4'	105.7°	110.5°
C4'	C5'	O5'	112.9°	109.4°
C4'	C5'	H5'1	111.0°	109.5°
C4'	C5'	H5'2	110.9°	109.4°
O4'	C4'	H4'	109.9°	110.5°
O5'	C5'	H5'1	110.9°	109.5°
O5'	C5'	H5'2	110.9°	109.5°
C5'	O5'	H5'	112.9°	106.8°
H5'1	C5'	H5'2	99.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C6	C6'	H6'1	H6'2	125.3°	120.0°
C6	C6'	H6'1	H6'3	125.3°	120.0°
C6	C6'	H6'2	H6'3	112.5°	120.0°
C6'	C6	N1	C5	180.0°	179.8°
C6'	C6	N1	C2	179.9°	180.0°
C6'	C6	C5	C4	179.7°	179.8°
C6'	C6	C5	N7	0.1°	0.6°
H6'1	C6'	H6'2	H6'3	112.5°	119.9°
H6'1	C6'	C6	N1	180.0°	90.0°
H6'1	C6'	C6	C5	0.0°	90.3°
H6'2	C6'	C6	N1	54.7°	150.0°
H6'2	C6'	C6	C5	125.3°	29.8°
H6'3	C6'	C6	N1	54.7°	30.0°
H6'3	C6'	C6	C5	125.3°	149.8°
C6	N1	C2	N3	0.1°	0.1°
C6	N1	C2	H2	180.0°	179.9°
N1	C6	C5	C4	0.3°	0.4°
N1	C6	C5	N7	179.9°	179.6°
C5	C6	N1	C2	0.1°	0.2°
C6	C5	C4	N3	0.3°	0.4°
C6	C5	C4	N7	179.8°	179.4°
C6	C5	C4	N9	179.7°	179.7°
C6	C5	N7	C8	179.7°	179.5°
N1	C2	N3	H2	180.0°	179.9°
N1	C2	N3	C4	0.1°	0.1°
C2	N3	C4	C5	0.1°	0.2°
C2	N3	C4	N9	179.9°	180.0°
H2	C2	N3	C4	180.0°	180.0°
N3	C4	C5	N9	180.0°	179.8°
N3	C4	C5	N7	179.9°	179.8°
N3	C4	N9	C8	179.9°	180.0°
N3	C4	N9	C1'	0.3°	0.1°
C4	C5	N7	C8	0.1°	0.3°
C5	C4	N9	C8	0.1°	0.2°
C5	C4	N9	C1'	179.7°	179.9°
N9	C4	C5	N7	0.1°	0.3°
C4	N9	C8	N7	0.1°	0.1°
C4	N9	C8	C1'	179.8°	179.9°
C4	N9	C8	H8	179.9°	180.0°
C4	N9	C1'	C2'	23.2°	90.3°
C4	N9	C1'	O4'	96.3°	151.7°
C4	N9	C1'	H1'	138.3°	30.7°
C5	N7	C8	N9	0.0°	0.1°
C5	N7	C8	H8	180.0°	179.8°
N7	C8	N9	H8	180.0°	179.9°
N7	C8	N9	C1'	179.7°	180.0°
C8	N9	C1'	C2'	157.0°	89.8°
C8	N9	C1'	O4'	83.5°	28.2°
C8	N9	C1'	H1'	41.9°	149.2°
H8	C8	N9	C1'	0.3°	0.1°
N9	C1'	C2'	O4'	122.0°	119.5°
N9	C1'	C2'	H1'	112.2°	121.0°
N9	C1'	O4'	H1'	113.2°	121.0°
N9	C1'	C2'	C3'	91.6°	121.4°
N9	C1'	C2'	H2'1	143.2°	119.9°
N9	C1'	C2'	H2'2	33.7°	2.8°
N9	C1'	O4'	C4'	120.3°	145.8°
C2'	C1'	O4'	H1'	116.5°	119.5°
C1'	C2'	C3'	H2'1	125.3°	118.7°
C1'	C2'	C3'	H2'2	125.2°	118.7°
C1'	C2'	H2'1	H2'2	119.7°	122.6°
C1'	C2'	C3'	O3'	159.0°	139.1°
C1'	C2'	C3'	C4'	37.9°	20.9°
C1'	C2'	C3'	H3'	83.3°	97.3°
C2'	C1'	O4'	C4'	10.0°	26.3°
O4'	C1'	C2'	C3'	30.4°	1.9°
O4'	C1'	C2'	H2'1	94.8°	120.6°
O4'	C1'	C2'	H2'2	155.7°	116.7°
C1'	O4'	C4'	C3'	13.7°	39.9°
C1'	O4'	C4'	C5'	136.2°	158.5°
C1'	O4'	C4'	H4'	106.7°	78.6°
H1'	C1'	C2'	C3'	156.2°	117.6°
H1'	C1'	C2'	H2'1	30.9°	1.1°
H1'	C1'	C2'	H2'2	78.5°	123.8°
H1'	C1'	O4'	C4'	126.4°	93.2°
C3'	C2'	H2'1	H2'2	119.7°	122.6°
C2'	C3'	O3'	C4'	112.2°	112.7°
C2'	C3'	O3'	H3'	125.8°	123.7°
C2'	C3'	C4'	H3'	125.4°	118.2°
C2'	C3'	O3'	H1	180.0°	61.5°
C2'	C3'	C4'	C5'	154.9°	155.7°
C2'	C3'	C4'	O4'	32.0°	37.0°
C2'	C3'	C4'	H4'	87.9°	81.4°
H2'1	C2'	C3'	O3'	33.7°	20.4°
H2'1	C2'	C3'	C4'	87.4°	97.8°
H2'1	C2'	C3'	H3'	151.4°	144.0°
H2'2	C2'	C3'	O3'	75.7°	102.2°
H2'2	C2'	C3'	C4'	163.1°	139.6°
H2'2	C2'	C3'	H3'	41.9°	21.4°
O3'	C3'	C4'	H3'	118.0°	123.6°
O3'	C3'	C4'	C5'	88.5°	86.1°
O3'	C3'	C4'	O4'	148.6°	155.1°
O3'	C3'	C4'	H4'	28.7°	36.7°
C4'	C3'	O3'	H1	67.8°	174.2°
C3'	C4'	C5'	O4'	120.1°	114.2°
C3'	C4'	C5'	H4'	120.2°	122.9°
C3'	C4'	O4'	H4'	120.3°	118.5°
C3'	C4'	C5'	O5'	174.5°	180.0°
C3'	C4'	C5'	H5'1	49.2°	60.0°
C3'	C4'	C5'	H5'2	60.2°	60.0°
H3'	C3'	O3'	H1	54.2°	62.2°
H3'	C3'	C4'	C5'	29.5°	37.5°
H3'	C3'	C4'	O4'	93.4°	81.3°
H3'	C3'	C4'	H4'	146.7°	160.3°
C5'	C4'	O4'	H4'	117.2°	122.9°
C4'	C5'	O5'	H5'1	125.3°	120.0°
C4'	C5'	O5'	H5'2	125.2°	119.9°
C4'	C5'	H5'1	H5'2	116.8°	120.0°
C4'	C5'	O5'	H5'	180.0°	179.9°
O4'	C4'	C5'	O5'	65.4°	65.7°
O4'	C4'	C5'	H5'1	169.3°	174.3°
O4'	C4'	C5'	H5'2	59.9°	54.2°
H4'	C4'	C5'	O5'	54.3°	57.1°
H4'	C4'	C5'	H5'1	71.0°	62.9°
H4'	C4'	C5'	H5'2	179.6°	177.1°
O5'	C5'	H5'1	H5'2	116.8°	120.0°
H5'1	C5'	O5'	H5'	54.7°	60.1°
H5'2	C5'	O5'	H5'	54.7°	60.0°

Definition date:	2003-04-04
Last modified:	2011-06-04
Release status:	REL
Processing site:	RCSB
Derived from:	1OVG