WJS

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O32	C31	doub	0.00Å	1.25Å
C31	O33	sing	0.00Å	1.25Å
C31	C30	sing	0.00Å	1.58Å
C30	C29	sing	0.00Å	1.58Å
C30	N34	sing	0.00Å	1.48Å
O28	C29	sing	0.00Å	1.41Å
O28	P25	sing	0.00Å	1.65Å
O26	P25	doub	0.00Å	1.49Å
P25	O24	sing	0.00Å	1.76Å
P25	O27	sing	0.00Å	1.49Å
O19	C18	doub	0.00Å	1.22Å
O24	C23	sing	0.00Å	1.37Å
C23	C22	sing	0.00Å	1.56Å
C21	C22	sing	0.00Å	1.55Å
C21	O20	sing	0.00Å	1.41Å
C22	O35	sing	0.00Å	1.38Å
C18	O20	sing	0.00Å	1.34Å
C18	C17	sing	0.00Å	1.51Å
C16	C17	sing	0.00Å	1.53Å
C16	C15	sing	0.00Å	1.54Å
C14	C13	sing	0.00Å	1.57Å
C14	C15	sing	0.00Å	1.54Å
C13	C12	sing	0.00Å	1.56Å
C12	C11	sing	0.00Å	1.55Å
C10	C11	sing	0.00Å	1.57Å
C10	C09	sing	0.00Å	1.56Å
C09	H1	sing	0.00Å	1.08Å
C10	H4	sing	0.00Å	1.08Å
C11	H5	sing	0.00Å	1.08Å
C12	H6	sing	0.00Å	1.08Å
C13	H7	sing	0.00Å	1.08Å
C21	H16	sing	0.00Å	1.10Å
C21	H17	sing	0.00Å	1.10Å
C22	H18	sing	0.00Å	1.10Å
C23	H19	sing	0.00Å	1.10Å
C23	H20	sing	0.00Å	1.10Å
O27	H21	sing	0.00Å	0.95Å
C29	H22	sing	0.00Å	1.10Å
C29	H23	sing	0.00Å	1.10Å
C30	H24	sing	0.00Å	1.10Å
O33	H25	sing	0.00Å	0.95Å
N34	H26	sing	0.00Å	1.00Å
N34	H27	sing	0.00Å	1.00Å
N34	H28	sing	0.00Å	1.00Å
O35	H29	sing	0.00Å	0.95Å
C09	C8	sing	0.00Å	425.87Å
C8	C7	sing	0.00Å	0.00Å
C7	C6	sing	0.00Å	0.00Å
C6	C5	sing	0.00Å	0.00Å
C5	C4	sing	0.00Å	0.00Å
C4	C3	sing	0.00Å	0.00Å
C3	C2	sing	0.00Å	0.00Å
C2	C1	sing	0.00Å	0.00Å
P25	H30	sing	0.00Å	408.87Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O32	C31	O33	122.2°	90.0°
O32	C31	C30	117.7°	90.0°
O33	C31	C30	120.2°	90.0°
C31	O33	H25	109.5°	90.0°
C31	C30	C29	114.0°	90.0°
C31	C30	N34	108.2°	90.0°
C31	C30	H24	108.4°	90.0°
C29	C30	N34	108.1°	90.0°
C30	C29	O28	113.5°	90.0°
C30	C29	H22	108.5°	90.0°
C30	C29	H23	108.5°	90.0°
C29	C30	H24	108.4°	90.0°
N34	C30	H24	109.7°	90.0°
C30	N34	H26	109.5°	90.0°
C30	N34	H27	109.5°	90.0°
C30	N34	H28	109.5°	90.0°
C29	O28	P25	124.8°	90.0°
O28	C29	H22	108.5°	90.0°
O28	C29	H23	108.5°	90.0°
O28	P25	O26	109.8°	90.0°
O28	P25	O24	108.2°	90.0°
O28	P25	O27	109.5°	90.0°
O28	P25	H30	49.8°	90.0°
O26	P25	O24	101.5°	90.0°
O26	P25	O27	123.8°	90.0°
O26	P25	H30	74.8°	90.0°
O24	P25	O27	102.6°	90.0°
P25	O24	C23	118.0°	90.0°
O24	P25	H30	151.0°	90.0°
P25	O27	H21	109.5°	90.0°
O27	P25	H30	103.0°	90.0°
O19	C18	O20	121.6°	90.0°
O19	C18	C17	123.3°	90.0°
O24	C23	C22	111.1°	90.0°
O24	C23	H19	109.1°	90.0°
O24	C23	H20	109.1°	90.0°
C23	C22	C21	113.8°	90.0°
C23	C22	O35	114.6°	90.0°
C23	C22	H18	106.5°	90.0°
C22	C23	H19	109.1°	90.0°
C22	C23	H20	109.1°	90.0°
C22	C21	O20	110.5°	90.0°
C21	C22	O35	106.2°	90.0°
C22	C21	H16	109.2°	90.0°
C22	C21	H17	109.2°	90.0°
C21	C22	H18	106.6°	90.0°
C21	O20	C18	120.6°	90.0°
O20	C21	H16	109.2°	90.0°
O20	C21	H17	109.2°	90.0°
O35	C22	H18	108.7°	90.0°
C22	O35	H29	109.5°	90.0°
O20	C18	C17	115.1°	90.0°
C18	C17	C16	113.5°	90.0°
C17	C16	C15	114.3°	90.0°
C16	C15	C14	114.9°	90.0°
C13	C14	C15	117.8°	90.0°
C14	C13	C12	116.7°	90.0°
C14	C13	H7	121.6°	90.0°
C13	C12	C11	117.7°	90.0°
C13	C12	H6	121.1°	90.0°
C12	C13	H7	121.7°	90.0°
C12	C11	C10	117.2°	90.0°
C12	C11	H5	121.5°	90.0°
C11	C12	H6	121.2°	90.0°
C11	C10	C09	117.4°	90.0°
C11	C10	H4	121.3°	90.0°
C10	C11	H5	121.4°	90.0°
C10	C09	H1	167.4°	90.0°
C09	C10	H4	121.3°	90.0°
C10	C09	C8	25.2°	90.0°
H1	C09	C8	167.4°	90.0°
H16	C21	H17	109.5°	90.0°
H19	C23	H20	109.5°	90.0°
H22	C29	H23	109.4°	90.0°
H26	N34	H27	109.4°	90.0°
H26	N34	H28	109.4°	90.0°
H27	N34	H28	109.5°	90.0°
C09	C8	C7	90.0°	90.0°
C8	C7	C6	90.0°	90.0°
C7	C6	C5	90.0°	90.0°
C6	C5	C4	90.0°	90.0°
C5	C4	C3	90.0°	90.0°
C4	C3	C2	90.0°	90.0°
C3	C2	C1	90.0°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O32	C31	O33	C30	179.7°	90.0°
O32	C31	C30	C29	51.5°	90.0°
O32	C31	C30	N34	171.8°	90.0°
O32	C31	C30	H24	69.3°	90.0°
O32	C31	O33	H25	0.0°	90.0°
O33	C31	C30	C29	128.7°	90.0°
O33	C31	C30	N34	8.5°	90.0°
O33	C31	C30	H24	110.4°	90.0°
C31	C30	C29	N34	120.3°	90.0°
C31	C30	C29	H24	120.8°	90.0°
C31	C30	N34	H24	118.1°	90.0°
C31	C30	C29	O28	140.0°	90.0°
C31	C30	C29	H22	99.4°	90.0°
C31	C30	C29	H23	19.4°	90.0°
C30	C31	O33	H25	179.7°	90.0°
C31	C30	N34	H26	180.0°	90.0°
C31	C30	N34	H27	60.0°	90.0°
C31	C30	N34	H28	60.0°	90.0°
C29	C30	N34	H24	118.1°	90.0°
C30	C29	O28	H22	120.6°	90.0°
C30	C29	O28	H23	120.6°	90.0°
C30	C29	O28	P25	94.3°	90.0°
C30	C29	H22	H23	118.2°	90.0°
C29	C30	N34	H26	56.2°	90.0°
C29	C30	N34	H27	176.2°	90.0°
C29	C30	N34	H28	63.8°	90.0°
N34	C30	C29	O28	99.8°	90.0°
N34	C30	C29	H22	20.8°	90.0°
N34	C30	C29	H23	139.6°	90.0°
C30	N34	H26	H27	120.0°	90.0°
C30	N34	H26	H28	120.0°	90.0°
C30	N34	H27	H28	120.0°	90.0°
C29	O28	P25	O26	116.2°	90.0°
C29	O28	P25	O24	133.8°	90.0°
C29	O28	P25	O27	22.7°	90.0°
O28	C29	H22	H23	118.2°	90.0°
O28	C29	C30	H24	19.2°	90.0°
C29	O28	P25	H30	68.1°	90.0°
O28	P25	O26	O24	114.4°	90.0°
O28	P25	O26	O27	131.8°	90.0°
O28	P25	O26	H30	36.1°	90.0°
O28	P25	O24	O27	115.6°	90.0°
O28	P25	O24	H30	36.1°	90.0°
O28	P25	O27	H30	51.6°	90.0°
O28	P25	O24	C23	163.2°	90.0°
O28	P25	O27	H21	132.0°	90.0°
P25	O28	C29	H22	26.3°	90.0°
P25	O28	C29	H23	145.1°	90.0°
O26	P25	O24	O27	128.9°	90.0°
O26	P25	O24	H30	79.5°	90.0°
O26	P25	O27	H30	80.3°	90.0°
O26	P25	O24	C23	47.7°	90.0°
O26	P25	O27	H21	0.0°	90.0°
O24	P25	O27	H30	166.4°	90.0°
P25	O24	C23	C22	163.8°	90.0°
P25	O24	C23	H19	75.9°	90.0°
P25	O24	C23	H20	43.6°	90.0°
O24	P25	O27	H21	113.3°	90.0°
O27	P25	O24	C23	81.2°	90.0°
O19	C18	O20	C21	0.3°	90.0°
O19	C18	O20	C17	179.9°	90.0°
O19	C18	C17	C16	6.1°	90.0°
O24	C23	C22	H19	120.2°	90.0°
O24	C23	C22	H20	120.3°	90.0°
O24	C23	C22	C21	154.8°	90.0°
O24	C23	C22	O35	82.7°	90.0°
O24	C23	C22	H18	37.6°	90.0°
O24	C23	H19	H20	119.2°	90.0°
C23	O24	P25	H30	127.1°	90.0°
C23	C22	C21	O35	127.1°	90.0°
C23	C22	C21	H18	117.1°	90.0°
C23	C22	C21	O20	161.7°	90.0°
C23	C22	O35	H18	119.1°	90.0°
C23	C22	C21	H16	78.2°	90.0°
C23	C22	C21	H17	41.5°	90.0°
C22	C23	H19	H20	119.3°	90.0°
C23	C22	O35	H29	180.0°	90.0°
C22	C21	O20	H16	120.2°	90.0°
C22	C21	O20	H17	120.2°	90.0°
C21	C22	O35	H18	114.3°	90.0°
C22	C21	O20	C18	132.4°	90.0°
C22	C21	H16	H17	119.5°	90.0°
C21	C22	C23	H19	34.5°	90.0°
C21	C22	C23	H20	85.0°	90.0°
C21	C22	O35	H29	53.4°	90.0°
O20	C21	C22	O35	34.6°	90.0°
C21	O20	C18	C17	179.6°	90.0°
O20	C21	H16	H17	119.5°	90.0°
O20	C21	C22	H18	81.2°	90.0°
O35	C22	C21	H16	154.8°	90.0°
O35	C22	C21	H17	85.6°	90.0°
O35	C22	C23	H19	157.1°	90.0°
O35	C22	C23	H20	37.6°	90.0°
O20	C18	C17	C16	174.0°	90.0°
C18	O20	C21	H16	12.2°	90.0°
C18	O20	C21	H17	107.5°	90.0°
C18	C17	C16	C15	174.7°	90.0°
C17	C16	C15	C14	165.9°	90.0°
C16	C15	C14	C13	119.0°	90.0°
C14	C13	C12	H7	180.0°	90.0°
C14	C13	C12	C11	174.0°	90.0°
C14	C13	C12	H6	6.0°	90.0°
C15	C14	C13	C12	17.9°	90.0°
C15	C14	C13	H7	162.1°	90.0°
C13	C12	C11	H6	180.0°	90.0°
C13	C12	C11	C10	29.1°	90.0°
C13	C12	C11	H5	150.9°	90.0°
C12	C11	C10	H5	180.0°	90.0°
C12	C11	C10	C09	169.2°	90.0°
C12	C11	C10	H4	10.8°	90.0°
C11	C12	C13	H7	6.0°	90.0°
C11	C10	C09	H4	180.0°	90.0°
C11	C10	C09	H1	125.6°	90.0°
C10	C11	C12	H6	150.9°	90.0°
C11	C10	C09	C8	54.3°	90.0°
C10	C09	H1	C8	179.8°	90.0°
C09	C10	C11	H5	10.8°	90.0°
C10	C09	C8	C7	90.0°	90.0°
H1	C09	C10	H4	54.4°	90.0°
H1	C09	C8	C7	90.0°	90.0°
H4	C10	C11	H5	169.2°	90.0°
H4	C10	C09	C8	125.7°	90.0°
H5	C11	C12	H6	29.1°	90.0°
H6	C12	C13	H7	174.0°	90.0°
H16	C21	C22	H18	39.0°	90.0°
H17	C21	C22	H18	158.6°	90.0°
H18	C22	C23	H19	82.6°	90.0°
H18	C22	C23	H20	157.9°	90.0°
H18	C22	O35	H29	60.9°	90.0°
H21	O27	P25	H30	80.3°	90.0°
H22	C29	C30	H24	139.8°	90.0°
H23	C29	C30	H24	101.4°	90.0°
H24	C30	N34	H26	61.9°	90.0°
H24	C30	N34	H27	58.1°	90.0°
H24	C30	N34	H28	178.1°	90.0°
H26	N34	H27	H28	119.9°	90.0°
C09	C8	C7	C6	90.0°	90.0°
C8	C7	C6	C5	90.0°	90.0°
C7	C6	C5	C4	90.0°	90.0°
C6	C5	C4	C3	90.0°	90.0°
C5	C4	C3	C2	90.0°	90.0°
C4	C3	C2	C1	90.0°	90.0°

Release date:	2020-11-11
Definition date:	2020-10-30
Last modified:	2020-11-06
Release status:	REL
Processing site:	RCSB
Derived from:	6WM2