MWG

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O1A	PA	doub	1.48Å	1.52Å
O3B	PB	doub	1.48Å	1.50Å
O2B	PB	sing	1.61Å	1.50Å
O2A	PA	sing	1.61Å	1.53Å
PA	O1	sing	1.61Å	1.69Å
PA	O3A	sing	1.61Å	1.66Å
PB	O3A	sing	1.61Å	1.66Å
PB	O1B	sing	1.61Å	1.52Å
C1	C2	doub	1.31Å	1.33Å
O1	C3	sing	1.43Å	1.41Å
C2	C3	sing	1.51Å	1.54Å
C3	C10	sing	1.53Å	1.53Å
C3	C4	sing	1.53Å	1.55Å
C4	C5	sing	1.53Å	1.53Å
C5	C6	sing	1.51Å	1.56Å
C6	C7	doub	1.31Å	1.35Å
C7	C9	sing	1.51Å	1.57Å
C7	C8	sing	1.51Å	1.58Å
C9	F9	sing	1.40Å	1.37Å
C8	F8	sing	1.40Å	1.37Å
C1	H1	sing	1.08Å	1.08Å
C1	H2	sing	1.08Å	1.08Å
C2	H3	sing	1.08Å	1.08Å
C4	H4	sing	1.09Å	1.10Å
C4	H5	sing	1.09Å	1.10Å
C5	H6	sing	1.09Å	1.10Å
C5	H7	sing	1.09Å	1.10Å
C6	H8	sing	1.08Å	1.08Å
C8	H9	sing	1.09Å	1.10Å
C8	H10	sing	1.09Å	1.10Å
C9	H11	sing	1.09Å	1.10Å
C9	H12	sing	1.09Å	1.10Å
C10	H13	sing	1.09Å	1.10Å
C10	H14	sing	1.09Å	1.10Å
C10	H15	sing	1.09Å	1.10Å
O1B	H16	sing	0.97Å	0.95Å
O2A	H17	sing	0.97Å	0.95Å
O2B	H18	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O1A	PA	O2A	107.8°	109.4°
O1A	PA	O1	107.8°	109.4°
O1A	PA	O3A	108.9°	109.5°
O3B	PB	O2B	110.1°	109.5°
O3B	PB	O3A	110.6°	109.4°
O3B	PB	O1B	108.1°	109.5°
O2B	PB	O3A	110.0°	109.5°
O2B	PB	O1B	109.3°	109.5°
PB	O2B	H18	109.5°	114.0°
O2A	PA	O1	110.5°	109.5°
O2A	PA	O3A	111.1°	109.5°
PA	O2A	H17	109.5°	114.0°
O1	PA	O3A	110.7°	109.5°
PA	O1	C3	118.2°	123.0°
PA	O3A	PB	114.5°	134.0°
O3A	PB	O1B	108.6°	109.5°
PB	O1B	H16	109.5°	114.0°
C1	C2	C3	121.4°	120.0°
C2	C1	H1	120.0°	120.0°
C2	C1	H2	120.0°	120.0°
C1	C2	H3	119.3°	120.0°
O1	C3	C2	110.0°	109.5°
O1	C3	C10	114.9°	109.5°
O1	C3	C4	107.1°	109.5°
C2	C3	C10	108.2°	109.4°
C2	C3	C4	108.8°	109.5°
C3	C2	H3	119.3°	120.0°
C10	C3	C4	107.7°	109.5°
C3	C10	H13	109.5°	109.5°
C3	C10	H14	109.5°	109.5°
C3	C10	H15	109.5°	109.5°
C3	C4	C5	109.5°	109.5°
C3	C4	H4	109.5°	109.5°
C3	C4	H5	109.5°	109.5°
C4	C5	C6	110.1°	109.5°
C5	C4	H4	109.5°	109.4°
C5	C4	H5	109.5°	109.4°
C4	C5	H6	109.3°	109.4°
C4	C5	H7	109.3°	109.5°
C5	C6	C7	120.4°	120.0°
C6	C5	H6	109.3°	109.5°
C6	C5	H7	109.3°	109.5°
C5	C6	H8	119.8°	120.0°
C6	C7	C9	120.6°	119.9°
C6	C7	C8	120.2°	120.0°
C7	C6	H8	119.8°	120.0°
C9	C7	C8	119.2°	120.0°
C7	C9	F9	108.8°	109.5°
C7	C9	H11	109.7°	109.4°
C7	C9	H12	109.6°	109.5°
C7	C8	F8	110.3°	109.5°
C7	C8	H9	109.3°	109.5°
C7	C8	H10	109.3°	109.5°
F9	C9	H11	109.6°	109.4°
F9	C9	H12	109.6°	109.5°
F8	C8	H9	109.3°	109.5°
F8	C8	H10	109.3°	109.5°
H1	C1	H2	120.0°	120.0°
H4	C4	H5	109.4°	109.5°
H6	C5	H7	109.5°	109.5°
H9	C8	H10	109.4°	109.4°
H11	C9	H12	109.5°	109.5°
H13	C10	H14	109.4°	109.5°
H13	C10	H15	109.5°	109.4°
H14	C10	H15	109.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O1A	PA	O2A	O1	117.5°	120.0°
O1A	PA	O2A	O3A	119.3°	120.0°
O1A	PA	O1	O3A	119.0°	120.0°
O1A	PA	O3A	PB	35.3°	45.0°
O1A	PA	O1	C3	169.9°	53.8°
O1A	PA	O2A	H17	0.0°	180.0°
O3B	PB	O2B	O3A	122.1°	120.0°
O3B	PB	O2B	O1B	118.7°	120.0°
O3B	PB	O3A	PA	57.6°	45.0°
O3B	PB	O3A	O1B	118.5°	120.0°
O3B	PB	O1B	H16	0.0°	60.0°
O3B	PB	O2B	H18	0.0°	180.0°
O2B	PB	O3A	PA	64.2°	75.0°
O2B	PB	O3A	O1B	119.6°	120.0°
O2B	PB	O1B	H16	119.9°	60.0°
O2A	PA	O1	O3A	123.5°	120.0°
O2A	PA	O3A	PB	83.3°	75.0°
O2A	PA	O1	C3	52.4°	66.1°
O1	PA	O3A	PB	153.6°	165.0°
PA	O1	C3	C2	97.5°	76.8°
PA	O1	C3	C10	24.9°	43.2°
PA	O1	C3	C4	144.4°	163.2°
O1	PA	O2A	H17	117.5°	60.0°
PA	O3A	PB	O1B	176.2°	165.0°
O3A	PA	O1	C3	71.1°	173.9°
O3A	PA	O2A	H17	119.3°	60.0°
O3A	PB	O1B	H16	120.1°	180.0°
O3A	PB	O2B	H18	122.1°	60.0°
O1B	PB	O2B	H18	118.7°	60.0°
C1	C2	C3	O1	16.9°	9.6°
C1	C2	C3	H3	180.0°	180.0°
C1	C2	C3	C10	109.4°	129.6°
C1	C2	C3	C4	133.9°	110.4°
C2	C1	H1	H2	180.0°	179.7°
O1	C3	C2	C10	126.3°	120.0°
O1	C3	C2	C4	117.0°	120.1°
O1	C3	C10	C4	119.2°	120.1°
O1	C3	C4	C5	159.1°	65.0°
O1	C3	C2	H3	163.1°	170.4°
O1	C3	C4	H4	39.1°	175.0°
O1	C3	C4	H5	80.9°	54.9°
O1	C3	C10	H13	180.0°	180.0°
O1	C3	C10	H14	60.0°	60.1°
O1	C3	C10	H15	60.0°	60.0°
C2	C3	C10	C4	117.4°	120.0°
C2	C3	C4	C5	40.2°	175.0°
C3	C2	C1	H1	0.0°	2.1°
C3	C2	C1	H2	180.0°	177.6°
C2	C3	C4	H4	79.8°	55.0°
C2	C3	C4	H5	160.3°	65.1°
C2	C3	C10	H13	56.6°	60.0°
C2	C3	C10	H14	176.6°	180.0°
C2	C3	C10	H15	63.4°	60.0°
C10	C3	C4	C5	76.8°	55.0°
C10	C3	C2	H3	70.6°	50.4°
C10	C3	C4	H4	163.2°	65.0°
C10	C3	C4	H5	43.2°	175.0°
C3	C10	H13	H14	120.0°	120.0°
C3	C10	H13	H15	120.0°	120.0°
C3	C10	H14	H15	120.0°	120.0°
C3	C4	C5	H4	120.0°	120.0°
C3	C4	C5	H5	120.0°	120.0°
C3	C4	C5	C6	164.4°	180.0°
C4	C3	C2	H3	46.1°	69.6°
C3	C4	H4	H5	120.0°	120.0°
C3	C4	C5	H6	44.3°	60.0°
C3	C4	C5	H7	75.5°	60.0°
C4	C3	C10	H13	60.8°	60.0°
C4	C3	C10	H14	59.2°	60.0°
C4	C3	C10	H15	179.2°	179.9°
C4	C5	C6	H6	120.1°	120.0°
C4	C5	C6	H7	120.1°	120.0°
C4	C5	C6	C7	90.3°	118.7°
C5	C4	H4	H5	120.0°	120.0°
C4	C5	H6	H7	119.7°	120.0°
C4	C5	C6	H8	89.7°	61.2°
C5	C6	C7	H8	180.0°	179.9°
C5	C6	C7	C9	0.1°	6.7°
C5	C6	C7	C8	179.9°	173.3°
C6	C5	C4	H4	75.6°	60.0°
C6	C5	C4	H5	44.4°	60.0°
C6	C5	H6	H7	119.7°	120.0°
C6	C7	C9	C8	179.8°	179.9°
C6	C7	C9	F9	166.5°	91.8°
C6	C7	C8	F8	174.3°	95.0°
C7	C6	C5	H6	29.8°	1.2°
C7	C6	C5	H7	149.6°	121.2°
C6	C7	C8	H9	65.6°	144.9°
C6	C7	C8	H10	54.1°	24.9°
C6	C7	C9	H11	73.6°	148.3°
C6	C7	C9	H12	46.6°	28.3°
C7	C9	F9	H11	119.9°	119.9°
C7	C9	F9	H12	119.9°	120.1°
C9	C7	C8	F8	5.9°	85.0°
C9	C7	C6	H8	179.9°	173.3°
C9	C7	C8	H9	114.2°	35.0°
C9	C7	C8	H10	126.1°	155.0°
C7	C9	H11	H12	120.3°	120.0°
C8	C7	C9	F9	13.3°	88.2°
C7	C8	F8	H9	120.1°	120.1°
C7	C8	F8	H10	120.1°	120.0°
C8	C7	C6	H8	0.1°	6.8°
C7	C8	H9	H10	119.6°	120.0°
C8	C7	C9	H11	106.6°	31.8°
C8	C7	C9	H12	133.2°	151.8°
F9	C9	H11	H12	120.3°	120.0°
F8	C8	H9	H10	119.6°	120.0°
H1	C1	C2	H3	180.0°	177.9°
H2	C1	C2	H3	0.0°	2.3°
H4	C4	C5	H6	164.3°	180.0°
H4	C4	C5	H7	44.5°	60.0°
H5	C4	C5	H6	75.7°	60.0°
H5	C4	C5	H7	164.5°	179.9°
H6	C5	C6	H8	150.2°	178.8°
H7	C5	C6	H8	30.4°	58.8°
H13	C10	H14	H15	120.0°	120.0°

Release date:	2019-09-04
Definition date:	2019-04-23
Last modified:	2019-08-30
Release status:	REL
Processing site:	RCSB
Derived from:	6ONM