U8W

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O5	P1	doub	1.48Å	1.53Å
O3	P1	sing	1.61Å	1.52Å
P1	O2	sing	1.61Å	1.60Å
P1	O4	sing	1.61Å	1.49Å
O2	C2	sing	1.43Å	1.43Å
O10	S1	doub	1.42Å	1.48Å
O8	C5	sing	1.43Å	1.41Å
O11	S1	doub	1.42Å	1.51Å
C2	C1	sing	1.53Å	1.51Å
S1	O9	sing	1.52Å	1.49Å
S1	C6	sing	1.81Å	1.68Å
C5	C6	sing	1.53Å	1.53Å
C5	C4	sing	1.53Å	1.54Å
C3	C1	sing	1.53Å	1.54Å
C3	C4	sing	1.53Å	1.62Å
C3	O6	sing	1.43Å	1.34Å
C4	O7	sing	1.43Å	1.50Å
C4	H1	sing	1.09Å	1.10Å
C5	H2	sing	1.09Å	1.10Å
C6	H3	sing	1.09Å	1.10Å
C6	H4	sing	1.09Å	1.10Å
C3	H5	sing	1.09Å	1.10Å
O8	H6	sing	0.97Å	0.95Å
O7	H7	sing	0.97Å	0.95Å
O6	H8	sing	0.97Å	0.95Å
C1	H9	sing	1.09Å	1.10Å
C2	H11	sing	1.09Å	1.10Å
C2	H12	sing	1.09Å	1.10Å
O3	H13	sing	0.97Å	0.95Å
O4	H14	sing	0.97Å	0.95Å
C1	O1	sing	1.43Å	1.33Å
O9	H15	sing	0.97Å	0.95Å
O1	H10	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O5	P1	O3	113.0°	109.5°
O5	P1	O2	104.3°	109.5°
O5	P1	O4	117.5°	109.4°
O3	P1	O2	104.2°	109.5°
O3	P1	O4	109.1°	109.4°
P1	O3	H13	109.5°	114.0°
O2	P1	O4	107.5°	109.5°
P1	O2	C2	122.0°	123.0°
P1	O4	H14	109.5°	114.0°
O2	C2	C1	113.5°	109.5°
O2	C2	H11	108.4°	109.5°
O2	C2	H12	108.5°	109.4°
O10	S1	O11	115.9°	121.0°
O10	S1	O9	106.4°	104.3°
O10	S1	C6	108.9°	110.6°
O8	C5	C6	105.7°	109.5°
O8	C5	C4	105.9°	109.5°
O8	C5	H2	110.7°	109.5°
C5	O8	H6	109.5°	114.0°
O11	S1	O9	96.8°	104.3°
O11	S1	C6	117.2°	110.5°
C2	C1	C3	124.3°	109.4°
C2	C1	H9	90.9°	109.4°
C1	C2	H11	108.5°	109.5°
C1	C2	H12	108.4°	109.5°
C2	C1	O1	116.7°	109.5°
O9	S1	C6	110.3°	104.5°
S1	O9	H15	109.5°	114.0°
S1	C6	C5	117.9°	109.5°
S1	C6	H3	107.3°	109.5°
S1	C6	H4	107.3°	109.4°
C6	C5	C4	116.4°	109.5°
C6	C5	H2	109.1°	109.4°
C5	C6	H3	107.3°	109.5°
C5	C6	H4	107.3°	109.5°
C5	C4	C3	112.7°	109.4°
C5	C4	O7	99.0°	109.5°
C5	C4	H1	107.2°	109.5°
C4	C5	H2	108.9°	109.5°
C1	C3	C4	115.5°	109.4°
C1	C3	O6	104.3°	109.5°
C1	C3	H5	110.9°	109.5°
C3	C1	H9	90.9°	109.5°
C3	C1	O1	119.0°	109.5°
C4	C3	O6	101.8°	109.5°
C3	C4	O7	123.0°	109.5°
C3	C4	H1	106.4°	109.5°
C4	C3	H5	109.8°	109.5°
O6	C3	H5	114.2°	109.5°
C3	O6	H8	109.5°	114.0°
O7	C4	H1	107.6°	109.5°
C4	O7	H7	109.5°	114.0°
H3	C6	H4	109.5°	109.4°
H9	C1	O1	91.0°	109.5°
H11	C2	H12	109.4°	109.5°
C1	O1	H10	109.5°	113.9°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O5	P1	O3	O2	112.7°	120.1°
O5	P1	O3	O4	132.8°	119.9°
O5	P1	O2	O4	125.5°	120.0°
O5	P1	O2	C2	179.7°	55.0°
O5	P1	O3	H13	0.0°	180.0°
O5	P1	O4	H14	0.0°	60.0°
O3	P1	O2	O4	115.8°	120.0°
O3	P1	O2	C2	61.6°	65.1°
O3	P1	O4	H14	130.4°	59.9°
P1	O2	C2	C1	137.4°	180.0°
P1	O2	C2	H11	102.0°	59.9°
P1	O2	C2	H12	16.8°	60.0°
O2	P1	O3	H13	112.7°	60.0°
O2	P1	O4	H14	117.2°	179.9°
O4	P1	O2	C2	54.2°	174.9°
O4	P1	O3	H13	132.8°	60.0°
O2	C2	C1	H11	120.6°	120.0°
O2	C2	C1	H12	120.6°	120.0°
O2	C2	C1	C3	3.5°	175.0°
O2	C2	C1	H9	88.1°	55.0°
O2	C2	H11	H12	118.2°	119.9°
O2	C2	C1	O1	179.6°	65.0°
O10	S1	O11	O9	112.0°	116.8°
O10	S1	O11	C6	131.0°	131.5°
O10	S1	O9	C6	118.0°	116.1°
O10	S1	C6	C5	64.6°	68.3°
O10	S1	C6	H3	56.6°	171.6°
O10	S1	C6	H4	174.2°	51.6°
O10	S1	O9	H15	119.6°	63.9°
O8	C5	C6	S1	63.4°	65.0°
O8	C5	C6	C4	117.1°	120.0°
O8	C5	C6	H2	119.1°	120.0°
O8	C5	C4	H2	119.1°	120.0°
O8	C5	C4	C3	73.2°	60.0°
O8	C5	C4	O7	155.2°	180.0°
O8	C5	C4	H1	43.5°	60.0°
O8	C5	C6	H3	57.8°	175.0°
O8	C5	C6	H4	175.3°	55.0°
O11	S1	O9	C6	122.4°	116.0°
O11	S1	C6	C5	69.5°	68.4°
O11	S1	C6	H3	169.3°	51.7°
O11	S1	C6	H4	51.7°	171.6°
O11	S1	O9	H15	0.0°	64.0°
C2	C1	C3	H9	91.6°	120.0°
C2	C1	C3	O1	176.7°	120.0°
C2	C1	C3	C4	105.7°	175.0°
C2	C1	C3	O6	143.5°	55.0°
C2	C1	C3	H5	20.1°	65.0°
C2	C1	H9	O1	116.7°	120.0°
C1	C2	H11	H12	118.1°	120.0°
C2	C1	O1	H10	180.0°	60.0°
O9	S1	C6	C5	179.0°	180.0°
O9	S1	C6	H3	59.8°	59.9°
O9	S1	C6	H4	57.8°	60.0°
S1	C6	C5	H3	121.2°	120.1°
S1	C6	C5	H4	121.2°	120.0°
S1	C6	C5	C4	179.4°	175.0°
S1	C6	C5	H2	55.7°	55.1°
S1	C6	H3	H4	116.2°	120.0°
C6	S1	O9	H15	122.4°	180.0°
C6	C5	C4	H2	123.8°	119.9°
C6	C5	C4	C3	169.7°	180.0°
C6	C5	C4	O7	38.1°	60.0°
C6	C5	C4	H1	73.6°	60.0°
C5	C6	H3	H4	116.1°	120.0°
C6	C5	O8	H6	29.1°	60.0°
C5	C4	C3	C1	136.5°	175.0°
C5	C4	C3	O7	118.3°	120.0°
C5	C4	C3	H1	117.2°	120.0°
C5	C4	C3	O6	111.2°	55.0°
C5	C4	O7	H1	111.4°	120.0°
C4	C5	C6	H3	59.4°	54.9°
C4	C5	C6	H4	58.2°	65.0°
C5	C4	C3	H5	10.2°	65.0°
C4	C5	O8	H6	153.1°	60.0°
C5	C4	O7	H7	180.0°	60.0°
C1	C3	C4	O6	112.3°	120.0°
C1	C3	C4	H5	126.4°	120.0°
C1	C3	O6	H5	121.2°	120.0°
C1	C3	C4	O7	105.2°	55.0°
C1	C3	C4	H1	19.3°	65.0°
C1	C3	O6	H8	180.0°	59.9°
C3	C1	H9	O1	119.0°	120.1°
C3	C1	C2	H11	117.1°	65.0°
C3	C1	C2	H12	124.2°	55.0°
C3	C1	O1	H10	3.0°	60.0°
C4	C3	O6	H5	118.3°	120.0°
C3	C4	O7	H1	124.0°	120.0°
C3	C4	C5	H2	45.9°	60.1°
C3	C4	O7	H7	55.3°	60.0°
C4	C3	O6	H8	59.5°	60.0°
C4	C3	C1	H9	14.0°	65.0°
C4	C3	C1	O1	77.6°	55.0°
O6	C3	C4	O7	7.1°	65.0°
O6	C3	C4	H1	131.6°	175.0°
O6	C3	C1	H9	124.9°	175.0°
O6	C3	C1	O1	33.2°	65.0°
O7	C4	C5	H2	85.7°	59.9°
O7	C4	C3	H5	128.4°	175.0°
H1	C4	C5	H2	162.6°	180.0°
H1	C4	C3	H5	107.0°	55.0°
H1	C4	O7	H7	68.6°	180.0°
H2	C5	C6	H3	176.9°	65.0°
H2	C5	C6	H4	65.6°	175.0°
H2	C5	O8	H6	88.9°	180.0°
H5	C3	O6	H8	58.8°	180.0°
H5	C3	C1	H9	111.8°	54.9°
H5	C3	C1	O1	156.6°	175.0°
H9	C1	C2	H11	151.3°	175.0°
H9	C1	C2	H12	32.5°	65.0°
H9	C1	O1	H10	88.5°	180.0°
H11	C2	C1	O1	59.7°	55.0°
H12	C2	C1	O1	59.0°	175.0°

Release date:	2021-04-14
Definition date:	2021-02-03
Last modified:	2021-04-09
Release status:	REL
Processing site:	PDBE
Derived from:	7NE2