6SW

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O4	P	doub	1.48Å	1.49Å
O1	C9	doub	1.22Å	1.24Å
N1	C5	doub	1.30Å	1.35Å	Aromatic
N1	C6	sing	1.35Å	1.33Å	Aromatic
C5	N	sing	1.36Å	1.34Å	Aromatic
C6	C9	sing	1.42Å	1.47Å
C6	C7	doub	1.40Å	1.46Å	Aromatic
C9	N3	sing	1.35Å	1.34Å
P	O6	sing	1.61Å	1.53Å
P	O3	sing	1.63Å	1.60Å
P	O5	sing	1.62Å	1.64Å
O3	C2	sing	1.43Å	1.42Å
C2	C3	sing	1.53Å	1.49Å
C2	C1	sing	1.55Å	1.52Å
N	C7	sing	1.37Å	1.31Å	Aromatic
N	C4	sing	1.47Å	1.46Å
C3	C4	sing	1.55Å	1.52Å
C3	O2	sing	1.43Å	1.42Å
N3	C8	sing	1.36Å	1.35Å
C7	N2	sing	1.34Å	1.33Å
O5	C	sing	1.45Å	1.41Å
C4	O	sing	1.45Å	1.41Å
C	C1	sing	1.52Å	1.50Å
C1	O	sing	1.43Å	1.39Å
C8	N2	doub	1.30Å	1.34Å
C8	H1	sing	1.08Å	1.08Å
C5	H2	sing	1.08Å	1.08Å
O6	H3	sing	0.97Å	0.95Å
C2	H4	sing	1.09Å	1.10Å
N3	H5	sing	0.97Å	1.00Å
C4	H6	sing	1.09Å	1.10Å
C	H7	sing	1.09Å	1.10Å
C	H8	sing	1.09Å	1.10Å
C3	H9	sing	1.09Å	1.10Å
O2	H10	sing	0.97Å	0.95Å
C1	H11	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O4	P	O6	112.6°	109.9°
O4	P	O3	111.7°	110.0°
O4	P	O5	107.2°	110.0°
O1	C9	C6	119.7°	120.9°
O1	C9	N3	122.2°	120.9°
C5	N1	C6	107.0°	109.3°
N1	C5	N	109.5°	109.8°
N1	C5	H2	125.3°	125.1°
N1	C6	C9	135.9°	134.3°
N1	C6	C7	107.8°	107.3°
C5	N	C7	110.7°	107.5°
C5	N	C4	126.7°	126.3°
N	C5	H2	125.3°	125.1°
C9	C6	C7	116.3°	118.4°
C6	C9	N3	118.1°	118.1°
C6	C7	N	104.9°	106.1°
C6	C7	N2	120.5°	119.6°
C9	N3	C8	122.0°	120.4°
C9	N3	H5	119.0°	119.8°
O6	P	O3	113.9°	110.0°
O6	P	O5	109.0°	110.0°
P	O6	H3	109.5°	114.0°
O3	P	O5	101.5°	106.8°
P	O3	C2	117.7°	116.6°
P	O5	C	116.5°	120.2°
O3	C2	C3	119.9°	114.6°
O3	C2	C1	108.4°	106.2°
O3	C2	H4	109.6°	111.8°
C3	C2	C1	101.3°	100.9°
C2	C3	C4	100.6°	103.3°
C2	C3	O2	115.4°	110.7°
C3	C2	H4	108.5°	111.3°
C2	C3	H9	110.9°	110.7°
C2	C1	C	111.0°	109.0°
C2	C1	O	99.4°	103.0°
C1	C2	H4	108.3°	111.5°
C2	C1	H11	109.0°	109.5°
C7	N	C4	122.5°	126.2°
N	C7	N2	134.6°	134.3°
N	C4	C3	108.2°	110.0°
N	C4	O	110.3°	109.9°
N	C4	H6	110.6°	109.9°
C4	C3	O2	106.7°	110.6°
C3	C4	O	106.4°	107.1°
C3	C4	H6	109.8°	109.9°
C4	C3	H9	110.5°	110.7°
O2	C3	H9	112.0°	110.7°
C3	O2	H10	109.5°	114.0°
N3	C8	N2	122.1°	122.2°
N3	C8	H1	118.9°	118.9°
C8	N3	H5	119.0°	119.8°
C7	N2	C8	121.0°	121.2°
O5	C	C1	108.2°	106.8°
O5	C	H7	109.8°	110.0°
O5	C	H8	109.8°	110.0°
C4	O	C1	108.7°	105.4°
O	C4	H6	111.4°	109.9°
C	C1	O	116.9°	116.6°
C1	C	H7	109.8°	110.0°
C1	C	H8	109.8°	110.0°
C	C1	H11	109.2°	109.5°
O	C1	H11	110.8°	109.0°
N2	C8	H1	118.9°	118.9°
H7	C	H8	109.5°	110.1°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O4	P	O6	O3	128.5°	121.3°
O4	P	O6	O5	118.9°	121.3°
O4	P	O3	O5	114.0°	119.4°
O4	P	O3	C2	64.3°	81.3°
O4	P	O5	C	66.4°	85.4°
O4	P	O6	H3	0.0°	58.8°
O1	C9	C6	N1	2.5°	0.2°
O1	C9	C6	N3	178.6°	179.8°
O1	C9	C6	C7	178.8°	179.9°
O1	C9	N3	C8	179.5°	179.8°
O1	C9	N3	H5	0.6°	0.2°
N1	C5	N	H2	180.0°	180.0°
C5	N1	C6	C9	180.0°	180.0°
C5	N1	C6	C7	1.3°	0.3°
N1	C5	N	C7	1.6°	0.1°
N1	C5	N	C4	179.3°	180.0°
C6	N1	C5	N	1.7°	0.2°
N1	C6	C9	C7	178.7°	179.7°
N1	C6	C9	N3	178.9°	180.0°
N1	C6	C7	N	0.3°	0.2°
N1	C6	C7	N2	178.3°	179.7°
C6	N1	C5	H2	178.3°	179.8°
C5	N	C7	C6	0.7°	0.1°
C5	N	C7	C4	179.2°	180.0°
C5	N	C4	C3	68.7°	94.3°
C5	N	C7	N2	179.1°	179.4°
C5	N	C4	O	47.3°	23.5°
C5	N	C4	H6	171.0°	144.6°
C9	C6	C7	N	179.4°	180.0°
C6	C9	N3	C8	0.9°	0.0°
C9	C6	C7	N2	0.7°	0.6°
C6	C9	N3	H5	179.1°	180.0°
C7	C6	C9	N3	0.2°	0.3°
C6	C7	N	N2	178.4°	179.3°
C6	C7	N	C4	179.9°	179.9°
C6	C7	N2	C8	1.1°	0.6°
C9	N3	C8	H5	180.0°	180.0°
C9	N3	C8	N2	0.7°	0.0°
C9	N3	C8	H1	179.3°	179.7°
O6	P	O3	O5	117.0°	119.4°
O6	P	O3	C2	166.7°	157.4°
O6	P	O5	C	171.4°	153.4°
P	O3	C2	C3	173.5°	167.9°
P	O3	C2	C1	58.0°	57.5°
O3	P	O5	C	50.9°	34.0°
O3	P	O6	H3	128.5°	179.9°
P	O3	C2	H4	60.1°	64.3°
O5	P	O3	C2	49.8°	38.1°
P	O5	C	C1	60.3°	49.7°
O5	P	O6	H3	118.9°	62.5°
P	O5	C	H7	179.9°	169.0°
P	O5	C	H8	59.5°	69.6°
O3	C2	C3	C1	119.2°	113.6°
O3	C2	C3	H4	126.9°	128.1°
O3	C2	C1	H4	118.9°	122.0°
O3	C2	C3	C4	155.8°	139.4°
O3	C2	C3	O2	41.5°	20.9°
O3	C2	C1	C	61.1°	72.7°
O3	C2	C1	O	175.1°	162.9°
O3	C2	C3	H9	87.3°	102.2°
O3	C2	C1	H11	59.2°	47.1°
C3	C2	C1	H4	114.1°	118.2°
C2	C3	C4	N	105.3°	118.3°
C2	C3	C4	O2	120.8°	118.4°
C2	C3	C4	H9	117.2°	118.5°
C2	C3	O2	H9	128.2°	123.1°
C2	C3	C4	O	13.2°	1.2°
C3	C2	C1	C	171.8°	167.5°
C3	C2	C1	O	48.0°	43.1°
C2	C3	C4	H6	133.9°	120.6°
C2	C3	O2	H10	180.0°	180.0°
C3	C2	C1	H11	67.9°	72.7°
C1	C2	C3	C4	36.6°	25.8°
C1	C2	C3	O2	77.7°	92.6°
C2	C1	C	O5	62.8°	67.2°
C2	C1	O	C4	41.0°	43.7°
C2	C1	C	O	113.1°	115.9°
C2	C1	C	H11	120.2°	119.8°
C2	C1	O	H11	114.6°	116.2°
C2	C1	C	H7	177.4°	173.5°
C2	C1	C	H8	57.0°	52.1°
C1	C2	C3	H9	153.6°	144.3°
C7	N	C4	C3	110.3°	85.8°
C7	N	C4	O	133.6°	156.4°
N	C7	N2	C8	179.2°	179.9°
C7	N	C5	H2	178.4°	179.9°
C7	N	C4	H6	9.9°	35.4°
N	C4	C3	O	118.6°	119.5°
N	C4	C3	H6	120.7°	121.2°
N	C4	C3	O2	133.9°	123.3°
C4	N	C7	N2	1.7°	0.5°
N	C4	O	H6	123.3°	121.1°
N	C4	O	C1	135.2°	146.4°
C4	N	C5	H2	0.7°	0.0°
N	C4	C3	H9	11.9°	0.2°
C4	C3	O2	H9	121.0°	123.1°
C3	C4	O	H6	119.6°	119.4°
C3	C4	O	C1	18.1°	26.8°
C4	C3	C2	H4	77.3°	92.6°
C4	C3	O2	H10	69.2°	66.2°
O2	C3	C4	O	107.5°	117.2°
O2	C3	C2	H4	168.4°	149.0°
O2	C3	C4	H6	13.2°	2.1°
N3	C8	N2	C7	0.4°	0.3°
N3	C8	N2	H1	180.0°	179.7°
C7	N2	C8	H1	179.6°	180.0°
O5	C	C1	H7	119.8°	119.3°
O5	C	C1	H8	119.8°	119.3°
O5	C	C1	O	175.9°	176.9°
O5	C	H7	H8	120.6°	121.3°
O5	C	C1	H11	57.4°	52.6°
C4	O	C1	C	160.5°	163.0°
O	C4	C3	H9	130.4°	119.7°
C4	O	C1	H11	73.6°	72.5°
C	C1	O	H11	125.9°	124.6°
C	C1	C2	H4	57.7°	49.3°
C1	C	H7	H8	120.6°	121.4°
O	C1	C2	H4	66.0°	75.1°
C1	O	C4	H6	101.5°	92.6°
O	C1	C	H7	64.3°	57.6°
O	C1	C	H8	56.1°	63.8°
N2	C8	N3	H5	179.4°	180.0°
H1	C8	N3	H5	0.6°	0.3°
H4	C2	C3	H9	39.7°	25.9°
H4	C2	C1	H11	178.0°	169.1°
H6	C4	C3	H9	108.9°	120.9°
H7	C	C1	H11	62.4°	66.7°
H8	C	C1	H11	177.2°	171.9°
H9	C3	O2	H10	51.8°	56.9°

Release date:	2016-09-14
Definition date:	2016-06-16
Last modified:	2021-03-01
Release status:	REL
Processing site:	RCSB
Derived from:	5KHH