B6G

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O2	C6	sing	1.43Å	1.43Å
O3	C7	sing	1.43Å	1.43Å
C6	C7	sing	1.55Å	1.53Å
C6	C5	sing	1.54Å	1.53Å
C7	C8	sing	1.55Å	1.52Å
O6	P	doub	1.48Å	1.51Å
O1	C5	sing	1.43Å	1.44Å
O1	P	sing	1.61Å	1.63Å
C5	O4	sing	1.43Å	1.43Å
C8	O4	sing	1.44Å	1.43Å
C8	N1	sing	1.47Å	1.50Å
P	O5	sing	1.61Å	1.51Å
P	O	sing	1.61Å	1.62Å
N2	C9	doub	1.33Å	1.36Å	Aromatic
N2	C10	sing	1.32Å	1.35Å	Aromatic
N1	C9	sing	1.37Å	1.34Å	Aromatic
N1	C13	sing	1.36Å	1.35Å	Aromatic
O	C4	sing	1.34Å	1.47Å
C9	C12	sing	1.41Å	1.48Å	Aromatic
C10	N3	doub	1.32Å	1.35Å	Aromatic
C13	N5	doub	1.30Å	1.36Å	Aromatic
C4	O7	doub	1.21Å	1.22Å
C4	C3	sing	1.51Å	1.51Å
C12	N5	sing	1.35Å	1.34Å	Aromatic
C12	C11	doub	1.41Å	1.49Å	Aromatic
N3	C11	sing	1.33Å	1.35Å	Aromatic
N	C3	sing	1.47Å	1.47Å
C11	N4	sing	1.38Å	1.36Å
C3	C1	sing	1.53Å	1.54Å
C1	C	sing	1.53Å	1.52Å
C1	C2	sing	1.53Å	1.53Å
C8	H1	sing	1.09Å	1.10Å
C5	H2	sing	1.09Å	1.10Å
C6	H3	sing	1.09Å	1.10Å
C2	H4	sing	1.09Å	1.10Å
C2	H5	sing	1.09Å	1.10Å
C2	H6	sing	1.09Å	1.10Å
C3	H7	sing	1.09Å	1.10Å
N	H8	sing	1.01Å	1.00Å
N	H9	sing	1.01Å	1.00Å
C1	H11	sing	1.09Å	1.10Å
C	H12	sing	1.09Å	1.10Å
C	H13	sing	1.09Å	1.10Å
C	H14	sing	1.09Å	1.10Å
O5	H15	sing	0.97Å	0.95Å
C7	H16	sing	1.09Å	1.10Å
O3	H17	sing	0.97Å	0.95Å
O2	H18	sing	0.97Å	0.95Å
C13	H19	sing	1.08Å	1.08Å
N4	H20	sing	0.97Å	1.00Å
N4	H21	sing	0.97Å	1.00Å
C10	H22	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O2	C6	C7	112.7°	110.9°
O2	C6	C5	112.0°	110.8°
O2	C6	H3	109.9°	110.9°
C6	O2	H18	109.5°	114.0°
O3	C7	C6	113.3°	111.1°
O3	C7	C8	109.4°	111.1°
O3	C7	H16	110.1°	111.0°
C7	O3	H17	109.5°	114.0°
C7	C6	C5	104.9°	102.2°
C6	C7	C8	106.5°	100.9°
C7	C6	H3	108.5°	110.8°
C6	C7	H16	108.7°	111.1°
C6	C5	O1	115.4°	109.9°
C6	C5	O4	104.1°	107.6°
C6	C5	H2	107.6°	109.8°
C5	C6	H3	108.6°	110.9°
C7	C8	O4	105.1°	105.1°
C7	C8	N1	113.1°	110.3°
C7	C8	H1	108.9°	110.4°
C8	C7	H16	108.8°	111.2°
O6	P	O1	108.8°	109.5°
O6	P	O5	108.2°	109.4°
O6	P	O	107.9°	109.5°
C5	O1	P	123.8°	123.0°
O1	C5	O4	111.9°	109.8°
O1	C5	H2	108.7°	109.8°
O1	P	O5	111.5°	109.5°
O1	P	O	110.9°	109.5°
C5	O4	C8	111.9°	110.0°
O4	C5	H2	108.8°	109.8°
O4	C8	N1	110.5°	110.3°
O4	C8	H1	110.1°	110.4°
C8	N1	C9	126.8°	126.3°
C8	N1	C13	125.6°	126.3°
N1	C8	H1	109.2°	110.2°
O5	P	O	109.3°	109.4°
P	O5	H15	109.5°	114.0°
P	O	C4	124.8°	117.0°
C9	N2	C10	121.3°	120.6°
N2	C9	N1	135.6°	134.9°
N2	C9	C12	117.9°	119.1°
N2	C10	N3	123.4°	122.5°
N2	C10	H22	118.3°	118.8°
C9	N1	C13	107.6°	107.5°
N1	C9	C12	106.5°	106.0°
N1	C13	N5	111.7°	110.0°
N1	C13	H19	124.1°	125.0°
O	C4	O7	120.0°	120.0°
O	C4	C3	118.8°	120.0°
C9	C12	N5	106.6°	107.1°
C9	C12	C11	117.9°	118.2°
C10	N3	C11	121.8°	121.2°
N3	C10	H22	118.3°	118.7°
C13	N5	C12	107.6°	109.5°
N5	C13	H19	124.1°	125.0°
O7	C4	C3	121.2°	120.1°
C4	C3	N	107.5°	109.4°
C4	C3	C1	118.0°	109.5°
C4	C3	H7	108.1°	109.5°
N5	C12	C11	135.4°	134.7°
C12	C11	N3	117.6°	118.5°
C12	C11	N4	120.9°	120.7°
N3	C11	N4	121.5°	120.8°
N	C3	C1	106.4°	109.5°
N	C3	H7	108.7°	109.5°
C3	N	H8	109.5°	111.0°
C3	N	H9	109.5°	111.0°
C11	N4	H20	109.5°	119.9°
C11	N4	H21	109.5°	120.0°
C3	C1	C	116.3°	109.5°
C3	C1	C2	109.9°	109.5°
C1	C3	H7	107.8°	109.5°
C3	C1	H11	107.2°	109.5°
C	C1	C2	108.2°	109.4°
C	C1	H11	107.5°	109.5°
C1	C	H12	109.5°	109.4°
C1	C	H13	109.4°	109.5°
C1	C	H14	109.5°	109.5°
C1	C2	H4	109.5°	109.5°
C1	C2	H5	109.5°	109.5°
C1	C2	H6	109.4°	109.5°
C2	C1	H11	107.4°	109.5°
H4	C2	H5	109.5°	109.4°
H4	C2	H6	109.5°	109.4°
H5	C2	H6	109.5°	109.5°
H8	N	H9	109.5°	111.0°
H12	C	H13	109.5°	109.5°
H12	C	H14	109.5°	109.5°
H13	C	H14	109.5°	109.5°
H20	N4	H21	109.5°	120.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O2	C6	C7	O3	9.3°	33.9°
O2	C6	C7	C5	122.2°	118.2°
O2	C6	C7	H3	121.9°	123.6°
O2	C6	C5	H3	121.5°	123.6°
O2	C6	C7	C8	111.0°	84.0°
O2	C6	C5	O1	23.9°	22.8°
O2	C6	C5	O4	99.1°	96.8°
O2	C6	C5	H2	145.5°	143.7°
O2	C6	C7	H16	131.9°	158.0°
O3	C7	C6	C8	120.3°	117.9°
O3	C7	C6	H16	122.6°	124.1°
O3	C7	C6	C5	131.5°	152.0°
O3	C7	C8	H16	120.3°	124.2°
O3	C7	C8	O4	117.4°	154.4°
O3	C7	C8	N1	122.0°	86.8°
O3	C7	C8	H1	0.5°	35.3°
O3	C7	C6	H3	112.6°	89.7°
C7	C6	C5	H3	115.9°	118.2°
C6	C7	C8	H16	117.0°	117.9°
C7	C6	C5	O1	146.5°	140.9°
C7	C6	C5	O4	23.5°	21.3°
C6	C7	C8	O4	5.3°	36.5°
C6	C7	C8	N1	115.3°	155.4°
C6	C7	C8	H1	123.2°	82.5°
C7	C6	C5	H2	91.9°	98.2°
C6	C7	O3	H17	180.0°	61.5°
C7	C6	O2	H18	180.0°	180.0°
C5	C6	C7	C8	11.2°	34.1°
C6	C5	O1	O4	118.8°	118.2°
C6	C5	O1	H2	121.0°	120.9°
C6	C5	O1	P	135.1°	150.3°
C6	C5	O4	H2	114.5°	119.5°
C6	C5	O4	C8	29.0°	1.8°
C5	C6	C7	H16	105.9°	83.8°
C5	C6	O2	H18	62.0°	67.2°
C7	C8	O4	C5	21.8°	24.5°
C7	C8	O4	N1	122.3°	118.9°
C7	C8	O4	H1	117.1°	119.1°
C7	C8	N1	H1	121.3°	122.2°
C7	C8	N1	C9	94.6°	87.8°
C7	C8	N1	C13	87.0°	91.8°
C8	C7	C6	H3	127.1°	152.4°
C8	C7	O3	H17	61.4°	173.0°
O6	P	O1	C5	122.3°	55.0°
O6	P	O1	O5	119.3°	120.0°
O6	P	O1	O	118.6°	120.1°
O6	P	O5	O	117.3°	120.0°
O6	P	O	C4	141.8°	54.9°
O6	P	O5	H15	0.0°	180.0°
O1	C5	O4	H2	120.1°	120.8°
O1	C5	O4	C8	154.3°	117.9°
C5	O1	P	O5	118.3°	65.0°
C5	O1	P	O	3.7°	175.0°
O1	C5	C6	H3	97.6°	100.9°
P	O1	C5	O4	106.1°	91.4°
O1	P	O5	O	123.0°	120.0°
O1	P	O	C4	99.1°	175.0°
P	O1	C5	H2	14.1°	29.4°
O1	P	O5	H15	119.7°	59.9°
C5	O4	C8	N1	100.4°	143.3°
C5	O4	C8	H1	138.9°	94.6°
O4	C5	C6	H3	139.3°	139.5°
O4	C8	N1	H1	121.2°	122.1°
O4	C8	N1	C9	148.0°	156.5°
O4	C8	N1	C13	30.4°	23.8°
C8	O4	C5	H2	85.6°	121.3°
O4	C8	C7	H16	122.3°	81.4°
C8	N1	C9	N2	0.9°	0.0°
C8	N1	C9	C13	178.7°	179.7°
C8	N1	C9	C12	179.0°	179.9°
C8	N1	C13	N5	178.9°	180.0°
N1	C8	C7	H16	1.7°	37.5°
C8	N1	C13	H19	1.1°	0.1°
O5	P	O	C4	24.3°	65.0°
P	O	C4	O7	35.3°	0.1°
P	O	C4	C3	143.6°	180.0°
O	P	O5	H15	117.3°	60.0°
N2	C9	N1	C12	179.9°	179.8°
N2	C9	N1	C13	179.6°	179.8°
C9	N2	C10	N3	0.1°	0.7°
N2	C9	C12	N5	179.6°	179.7°
N2	C9	C12	C11	0.5°	0.0°
C9	N2	C10	H22	179.9°	179.6°
C10	N2	C9	N1	179.8°	180.0°
C10	N2	C9	C12	0.3°	0.2°
N2	C10	N3	H22	180.0°	178.9°
N2	C10	N3	C11	0.0°	1.1°
C9	N1	C13	N5	0.2°	0.3°
N1	C9	C12	N5	0.3°	0.4°
N1	C9	C12	C11	179.6°	179.8°
C9	N1	C8	H1	26.8°	34.3°
C9	N1	C13	H19	179.8°	179.8°
C13	N1	C9	C12	0.3°	0.4°
N1	C13	N5	H19	180.0°	179.9°
N1	C13	N5	C12	0.0°	0.0°
C13	N1	C8	H1	151.7°	146.0°
O	C4	O7	C3	178.9°	179.9°
O	C4	C3	N	1.4°	160.0°
O	C4	C3	C1	118.9°	80.1°
O	C4	C3	H7	118.5°	40.0°
C9	C12	N5	C13	0.1°	0.2°
C9	C12	N5	C11	179.8°	179.7°
C9	C12	C11	N3	0.5°	0.3°
C9	C12	C11	N4	179.8°	179.7°
C10	N3	C11	C12	0.2°	0.8°
C10	N3	C11	N4	179.9°	179.2°
C13	N5	C12	C11	179.7°	180.0°
O7	C4	C3	N	177.6°	19.9°
O7	C4	C3	C1	62.2°	100.0°
O7	C4	C3	H7	60.4°	140.0°
C4	C3	N	C1	127.3°	120.0°
C4	C3	N	H7	116.8°	120.1°
C4	C3	C1	H7	122.8°	120.1°
C4	C3	C1	C	30.4°	60.1°
C4	C3	C1	C2	153.7°	180.0°
C4	C3	N	H8	180.0°	60.0°
C4	C3	N	H9	60.0°	176.1°
C4	C3	C1	H11	89.8°	60.0°
N5	C12	C11	N3	179.8°	180.0°
N5	C12	C11	N4	0.1°	0.0°
C12	N5	C13	H19	179.9°	179.9°
C12	C11	N3	N4	179.7°	180.0°
C12	C11	N4	H20	179.7°	180.0°
C12	C11	N4	H21	59.7°	0.0°
N3	C11	N4	H20	0.0°	0.0°
N3	C11	N4	H21	120.0°	180.0°
C11	N3	C10	H22	179.9°	180.0°
N	C3	C1	H7	116.4°	120.0°
N	C3	C1	C	151.2°	180.0°
N	C3	C1	C2	85.4°	60.0°
C3	N	H8	H9	120.0°	124.0°
N	C3	C1	H11	31.0°	60.0°
C11	N4	H20	H21	120.0°	180.0°
C3	C1	C	C2	124.2°	120.0°
C3	C1	C	H11	120.1°	120.0°
C3	C1	C2	H11	116.3°	120.0°
C3	C1	C2	H4	180.0°	60.0°
C3	C1	C2	H5	60.0°	180.0°
C3	C1	C2	H6	60.0°	60.0°
C1	C3	N	H8	52.7°	60.0°
C1	C3	N	H9	172.7°	64.0°
C3	C1	C	H12	180.0°	180.0°
C3	C1	C	H13	60.0°	60.0°
C3	C1	C	H14	60.0°	60.0°
C	C1	C2	H11	115.7°	120.0°
C	C1	C2	H4	52.1°	180.0°
C	C1	C2	H5	67.9°	60.0°
C	C1	C2	H6	172.1°	60.0°
C	C1	C3	H7	92.4°	60.0°
C1	C	H12	H13	120.0°	120.0°
C1	C	H12	H14	120.0°	120.0°
C1	C	H13	H14	120.0°	120.0°
C1	C2	H4	H5	120.0°	120.0°
C1	C2	H4	H6	120.0°	120.0°
C1	C2	H5	H6	120.0°	120.1°
C2	C1	C3	H7	31.0°	59.9°
C2	C1	C	H12	55.8°	60.0°
C2	C1	C	H13	175.8°	180.0°
C2	C1	C	H14	64.2°	60.0°
H1	C8	C7	H16	119.8°	159.6°
H2	C5	C6	H3	24.0°	20.0°
H3	C6	C7	H16	10.0°	34.4°
H3	C6	O2	H18	58.8°	56.4°
H4	C2	H5	H6	120.0°	120.0°
H4	C2	C1	H11	63.7°	60.0°
H5	C2	C1	H11	176.3°	60.0°
H6	C2	C1	H11	56.4°	180.0°
H7	C3	N	H8	63.2°	180.0°
H7	C3	N	H9	56.8°	56.0°
H7	C3	C1	H11	147.4°	179.9°
H11	C1	C	H12	59.9°	59.9°
H11	C1	C	H13	60.1°	60.0°
H11	C1	C	H14	179.9°	180.0°
H12	C	H13	H14	120.0°	120.0°
H16	C7	O3	H17	58.1°	62.7°

Release date:	2018-03-14
Definition date:	2017-08-01
Last modified:	2018-03-09
Release status:	REL
Processing site:	RCSB
Derived from:	5WMM