KB7

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O6	C6	doub	1.22Å	1.26Å
N1	C6	sing	1.35Å	1.34Å
N1	C2	sing	1.36Å	1.35Å
C6	C5	sing	1.41Å	1.47Å
N2	C2	sing	1.37Å	1.35Å
C2	N3	doub	1.31Å	1.36Å
C5	N7	sing	1.36Å	1.35Å	Aromatic
C5	C4	doub	1.40Å	1.47Å	Aromatic
N7	C8	doub	1.30Å	1.36Å	Aromatic
N3	C4	sing	1.34Å	1.35Å
C4	N9	sing	1.37Å	1.33Å	Aromatic
C8	N9	sing	1.37Å	1.35Å	Aromatic
N9	C1'	sing	1.47Å	1.45Å
C1'	C2'	sing	1.55Å	1.52Å
C1'	O4'	sing	1.44Å	1.39Å
O2'	C2'	sing	1.43Å	1.42Å
C2'	C3'	sing	1.55Å	1.54Å
O4'	C4'	sing	1.44Å	1.44Å
C3'	C4'	sing	1.54Å	1.53Å
C3'	O3'	sing	1.43Å	1.43Å
C4'	C5'	sing	1.53Å	1.50Å
C5'	O5'	sing	1.45Å	1.42Å
O5'	C1	sing	1.35Å	1.44Å
O2	C1	doub	1.22Å	1.22Å
C1	N4	sing	1.35Å	1.33Å
C9	C7	sing	1.53Å	1.52Å
C7	N4	sing	1.46Å	1.46Å
N4	H2	sing	0.97Å	1.00Å
C1'	H3	sing	1.09Å	1.10Å
C2'	H4	sing	1.09Å	1.10Å
O2'	H5	sing	0.97Å	0.95Å
C3'	H6	sing	1.09Å	1.10Å
O3'	H7	sing	0.97Å	0.95Å
C4'	H8	sing	1.09Å	1.10Å
C5'	H9	sing	1.09Å	1.10Å
C5'	H10	sing	1.09Å	1.10Å
N2	H11	sing	0.97Å	1.00Å
N2	H12	sing	0.97Å	1.00Å
C8	H13	sing	1.08Å	1.08Å
C7	H14	sing	1.09Å	1.10Å
C7	H15	sing	1.09Å	1.10Å
C9	H16	sing	1.09Å	1.10Å
C9	H17	sing	1.09Å	1.10Å
C9	H18	sing	1.09Å	1.10Å
N1	H19	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O6	C6	N1	121.9°	120.8°
O6	C6	C5	120.4°	120.8°
C6	N1	C2	122.9°	120.3°
N1	C6	C5	117.7°	118.4°
C6	N1	H19	118.6°	119.8°
N1	C2	N2	118.3°	119.1°
N1	C2	N3	123.0°	121.9°
C2	N1	H19	118.6°	119.8°
C6	C5	N7	135.9°	134.1°
C6	C5	C4	116.8°	118.6°
N2	C2	N3	118.7°	119.0°
C2	N2	H11	120.0°	120.0°
C2	N2	H12	120.0°	120.0°
C2	N3	C4	119.4°	121.1°
N7	C5	C4	107.4°	107.2°
C5	N7	C8	107.2°	109.3°
C5	C4	N3	120.2°	119.7°
C5	C4	N9	105.2°	106.1°
N7	C8	N9	110.2°	109.8°
N7	C8	H13	124.9°	125.1°
N3	C4	N9	134.5°	134.2°
C4	N9	C8	109.9°	107.5°
C4	N9	C1'	124.4°	126.3°
C8	N9	C1'	125.6°	126.2°
N9	C8	H13	124.9°	125.1°
N9	C1'	C2'	112.1°	110.6°
N9	C1'	O4'	108.5°	110.6°
N9	C1'	H3	110.5°	110.7°
C2'	C1'	O4'	104.7°	103.5°
C1'	C2'	O2'	112.4°	110.9°
C1'	C2'	C3'	102.5°	102.1°
C2'	C1'	H3	109.5°	110.6°
C1'	C2'	H4	108.2°	111.0°
C1'	O4'	C4'	107.7°	107.0°
O4'	C1'	H3	111.4°	110.6°
O2'	C2'	C3'	115.7°	110.9°
O2'	C2'	H4	109.6°	110.9°
C2'	O2'	H5	109.5°	114.0°
C2'	C3'	C4'	103.8°	104.2°
C2'	C3'	O3'	111.4°	110.5°
C3'	C2'	H4	108.0°	110.9°
C2'	C3'	H6	109.9°	110.5°
O4'	C4'	C3'	106.4°	107.3°
O4'	C4'	C5'	109.5°	109.9°
O4'	C4'	H8	109.5°	110.0°
C4'	C3'	O3'	110.2°	110.5°
C3'	C4'	C5'	114.3°	109.9°
C4'	C3'	H6	109.9°	110.5°
C3'	C4'	H8	108.3°	109.9°
O3'	C3'	H6	111.4°	110.6°
C3'	O3'	H7	109.5°	114.0°
C4'	C5'	O5'	108.5°	109.5°
C5'	C4'	H8	108.8°	109.9°
C4'	C5'	H9	109.7°	109.5°
C4'	C5'	H10	109.7°	109.5°
C5'	O5'	C1	121.0°	117.0°
O5'	C5'	H9	109.7°	109.5°
O5'	C5'	H10	109.7°	109.5°
O5'	C1	O2	119.1°	120.0°
O5'	C1	N4	114.6°	120.0°
O2	C1	N4	126.3°	120.0°
C1	N4	C7	119.3°	120.0°
C1	N4	H2	120.3°	120.0°
C9	C7	N4	112.4°	109.5°
C9	C7	H14	108.7°	109.4°
C9	C7	H15	108.7°	109.4°
C7	C9	H16	109.5°	109.4°
C7	C9	H17	109.5°	109.5°
C7	C9	H18	109.5°	109.5°
C7	N4	H2	120.4°	120.0°
N4	C7	H14	108.8°	109.5°
N4	C7	H15	108.7°	109.5°
H9	C5'	H10	109.5°	109.5°
H11	N2	H12	120.0°	120.0°
H14	C7	H15	109.5°	109.5°
H16	C9	H17	109.4°	109.4°
H16	C9	H18	109.5°	109.5°
H17	C9	H18	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O6	C6	N1	C5	179.2°	179.9°
O6	C6	N1	C2	179.8°	179.9°
O6	C6	C5	N7	0.8°	0.1°
O6	C6	C5	C4	179.2°	179.9°
O6	C6	N1	H19	0.2°	0.3°
C6	N1	C2	H19	180.0°	179.8°
C6	N1	C2	N2	179.7°	180.0°
C6	N1	C2	N3	1.3°	0.0°
N1	C6	C5	N7	180.0°	180.0°
N1	C6	C5	C4	0.0°	0.0°
C2	N1	C6	C5	0.6°	0.0°
N1	C2	N2	N3	179.0°	180.0°
N1	C2	N3	C4	1.4°	0.0°
N1	C2	N2	H11	178.9°	0.0°
N1	C2	N2	H12	1.1°	179.9°
C6	C5	N7	C4	180.0°	180.0°
C6	C5	N7	C8	179.9°	180.0°
C6	C5	C4	N3	0.1°	0.0°
C6	C5	C4	N9	179.8°	180.0°
C5	C6	N1	H19	179.4°	179.8°
N2	C2	N3	C4	179.7°	180.0°
C2	N2	H11	H12	180.0°	179.9°
N2	C2	N1	H19	0.2°	0.2°
C2	N3	C4	C5	0.8°	0.0°
C2	N3	C4	N9	179.1°	180.0°
N3	C2	N2	H11	0.0°	180.0°
N3	C2	N2	H12	180.0°	0.1°
N3	C2	N1	H19	178.7°	179.7°
N7	C5	C4	N3	179.9°	180.0°
N7	C5	C4	N9	0.2°	0.0°
C5	N7	C8	N9	0.4°	0.0°
C5	N7	C8	H13	179.6°	180.0°
C4	C5	N7	C8	0.1°	0.0°
C5	C4	N3	N9	179.9°	180.0°
C5	C4	N9	C8	0.4°	0.0°
C5	C4	N9	C1'	178.2°	179.9°
N7	C8	N9	C4	0.5°	0.0°
N7	C8	N9	H13	180.0°	179.9°
N7	C8	N9	C1'	178.3°	179.9°
N3	C4	N9	C8	179.7°	180.0°
N3	C4	N9	C1'	1.9°	0.1°
C4	N9	C8	C1'	177.8°	179.9°
C4	N9	C1'	C2'	126.6°	85.0°
C4	N9	C1'	O4'	118.3°	161.0°
C4	N9	C1'	H3	4.1°	38.0°
C4	N9	C8	H13	179.5°	180.0°
C8	N9	C1'	C2'	50.8°	95.0°
C8	N9	C1'	O4'	64.3°	19.1°
C8	N9	C1'	H3	173.3°	142.1°
N9	C1'	C2'	O4'	117.4°	118.5°
N9	C1'	C2'	H3	123.0°	123.0°
N9	C1'	O4'	H3	121.8°	123.0°
N9	C1'	C2'	O2'	81.7°	86.3°
N9	C1'	C2'	C3'	153.4°	155.6°
N9	C1'	O4'	C4'	159.1°	158.6°
N9	C1'	C2'	H4	39.5°	37.4°
C1'	N9	C8	H13	1.7°	0.0°
C2'	C1'	O4'	H3	118.3°	118.5°
C1'	C2'	O2'	C3'	117.3°	112.6°
C1'	C2'	O2'	H4	120.4°	123.7°
C1'	C2'	C3'	H4	114.0°	118.2°
C2'	C1'	O4'	C4'	39.2°	40.1°
C1'	C2'	C3'	C4'	19.5°	20.9°
C1'	C2'	C3'	O3'	99.0°	97.8°
C1'	C2'	O2'	H5	180.0°	180.0°
C1'	C2'	C3'	H6	137.0°	139.6°
O4'	C1'	C2'	O2'	160.9°	155.2°
O4'	C1'	C2'	C3'	36.0°	37.1°
C1'	O4'	C4'	C3'	26.0°	26.6°
C1'	O4'	C4'	C5'	150.0°	146.0°
O4'	C1'	C2'	H4	77.9°	81.1°
C1'	O4'	C4'	H8	90.8°	93.0°
O2'	C2'	C3'	H4	123.2°	123.6°
O2'	C2'	C3'	C4'	142.3°	139.1°
O2'	C2'	C3'	O3'	23.8°	20.4°
O2'	C2'	C1'	H3	41.3°	36.7°
O2'	C2'	C3'	H6	100.3°	102.3°
C2'	C3'	C4'	O4'	2.3°	2.0°
C2'	C3'	C4'	O3'	119.4°	118.7°
C2'	C3'	C4'	H6	117.5°	118.6°
C2'	C3'	O3'	H6	123.1°	122.6°
C2'	C3'	C4'	C5'	123.3°	121.4°
C3'	C2'	C1'	H3	83.6°	81.5°
C3'	C2'	O2'	H5	62.7°	67.4°
C2'	C3'	O3'	H7	180.0°	61.5°
C2'	C3'	C4'	H8	115.4°	117.5°
O4'	C4'	C3'	C5'	121.0°	119.4°
O4'	C4'	C3'	H8	117.7°	119.6°
O4'	C4'	C3'	O3'	121.7°	120.7°
O4'	C4'	C5'	H8	119.6°	121.2°
O4'	C4'	C5'	O5'	174.6°	67.2°
C4'	O4'	C1'	H3	79.1°	78.4°
O4'	C4'	C3'	H6	115.2°	116.6°
O4'	C4'	C5'	H9	54.7°	172.8°
O4'	C4'	C5'	H10	65.6°	52.8°
C4'	C3'	O3'	H6	122.3°	122.6°
C3'	C4'	C5'	H8	121.1°	121.0°
C3'	C4'	C5'	O5'	55.3°	175.0°
C4'	C3'	C2'	H4	94.5°	97.3°
C4'	C3'	O3'	H7	65.4°	176.2°
C3'	C4'	C5'	H9	64.6°	55.0°
C3'	C4'	C5'	H10	175.2°	65.0°
O3'	C3'	C4'	C5'	117.4°	119.9°
O3'	C3'	C2'	H4	147.0°	144.0°
O3'	C3'	C4'	H8	4.0°	1.1°
C4'	C5'	O5'	H9	119.9°	120.0°
C4'	C5'	O5'	H10	119.8°	120.0°
C4'	C5'	O5'	C1	168.3°	180.0°
C5'	C4'	C3'	H6	5.8°	2.8°
C4'	C5'	H9	H10	120.4°	120.0°
C5'	O5'	C1	O2	19.9°	0.0°
C5'	O5'	C1	N4	159.6°	180.0°
O5'	C5'	C4'	H8	65.8°	54.0°
O5'	C5'	H9	H10	120.4°	120.0°
O5'	C1	O2	N4	179.5°	180.0°
O5'	C1	N4	C7	11.8°	180.0°
O5'	C1	N4	H2	168.2°	0.0°
C1	O5'	C5'	H9	48.4°	60.0°
C1	O5'	C5'	H10	71.9°	60.0°
O2	C1	N4	C7	167.7°	0.0°
O2	C1	N4	H2	12.3°	180.0°
C1	N4	C7	C9	93.0°	180.0°
C1	N4	C7	H2	180.0°	180.0°
C1	N4	C7	H14	27.4°	60.0°
C1	N4	C7	H15	146.6°	60.1°
C9	C7	N4	H14	120.4°	120.0°
C9	C7	N4	H15	120.4°	120.0°
C9	C7	N4	H2	87.0°	0.0°
C9	C7	H14	H15	118.7°	119.9°
C7	C9	H16	H17	120.0°	120.0°
C7	C9	H16	H18	120.0°	120.0°
C7	C9	H17	H18	120.0°	120.1°
N4	C7	H14	H15	118.7°	120.0°
N4	C7	C9	H16	180.0°	59.9°
N4	C7	C9	H17	60.0°	60.0°
N4	C7	C9	H18	60.0°	180.0°
H2	N4	C7	H14	152.5°	120.0°
H2	N4	C7	H15	33.4°	120.0°
H3	C1'	C2'	H4	162.5°	160.3°
H4	C2'	O2'	H5	59.6°	56.3°
H4	C2'	C3'	H6	23.0°	21.3°
H6	C3'	O3'	H7	56.9°	61.1°
H6	C3'	C4'	H8	127.2°	123.8°
H8	C4'	C5'	H9	174.3°	66.0°
H8	C4'	C5'	H10	54.1°	174.0°
H14	C7	C9	H16	59.5°	180.0°
H14	C7	C9	H17	60.4°	60.1°
H14	C7	C9	H18	179.6°	60.0°
H15	C7	C9	H16	59.6°	60.0°
H15	C7	C9	H17	179.6°	180.0°
H15	C7	C9	H18	60.4°	60.0°
H16	C9	H17	H18	120.0°	120.0°

Release date:	2019-09-18
Definition date:	2018-11-19
Last modified:	2019-09-13
Release status:	REL
Processing site:	RCSB
Derived from:	6N3V