5OP

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.52Å	0.00Å
C1	H11	sing	1.09Å	0.00Å
C1	H12	sing	1.10Å	0.00Å
C1	H13A	sing	1.09Å	0.00Å
C2	C3	sing	1.53Å	68.97Å
C2	H21	sing	1.10Å	0.00Å
C2	H22	sing	1.10Å	0.00Å
C3	C4	sing	1.53Å	1.51Å
C3	H31	sing	1.10Å	1.10Å
C3	H32	sing	1.10Å	1.10Å
C4	C5	sing	1.53Å	1.35Å
C4	H41	sing	1.10Å	1.10Å
C4	H42	sing	1.10Å	1.10Å
C5	C6	sing	1.52Å	1.48Å
C5	H51	sing	1.10Å	1.10Å
C5	H52	sing	1.10Å	1.10Å
C6	C7	sing	1.49Å	1.53Å
C6	O4	doub	1.23Å	1.19Å
C7	C8	doub	1.34Å	1.53Å
C7	H7	sing	1.09Å	1.08Å
C8	C9	sing	1.49Å	1.53Å
C8	H8	sing	1.09Å	1.08Å
C9	C10	sing	1.54Å	64.44Å
C9	C13	sing	1.54Å	1.53Å
C9	H9	sing	1.10Å	1.10Å
C10	O1	sing	1.43Å	0.00Å
C10	C11	sing	1.53Å	0.00Å
C10	H10	sing	1.10Å	0.00Å
O1	HO1	sing	0.97Å	0.00Å
C11	C12	sing	1.51Å	0.00Å
C11	H111	sing	1.09Å	0.00Å
C11	H112	sing	1.09Å	0.00Å
C12	O2	doub	1.22Å	0.00Å
C12	C13	sing	1.52Å	63.16Å
C13	C14	sing	1.52Å	1.53Å
C13	H13	sing	1.10Å	1.10Å
C14	C15	sing	1.50Å	62.49Å
C14	H141	sing	1.10Å	1.10Å
C14	H142	sing	1.10Å	1.10Å
C15	C16	doub	1.34Å	0.00Å
C15	H15	sing	1.09Å	0.00Å
C16	C17	sing	1.50Å	0.00Å
C16	H16	sing	1.09Å	0.00Å
C17	C18	sing	1.54Å	0.00Å
C17	H171	sing	1.10Å	0.00Å
C17	H172	sing	1.10Å	0.00Å
C18	C19	sing	1.53Å	0.00Å
C18	H181	sing	1.10Å	0.00Å
C18	H182	sing	1.10Å	0.00Å
C19	C20	sing	1.51Å	0.00Å
C19	H191	sing	1.10Å	0.00Å
C19	H192	sing	1.10Å	0.00Å
C20	O3	sing	1.36Å	0.00Å
C20	O5	doub	1.22Å	0.00Å
O3	HO3	sing	0.98Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C2	C1	H11	90.0°	110.3°
C2	C1	H12	90.0°	111.0°
C2	C1	H13A	90.0°	111.0°
C1	C2	C3	90.0°	111.5°
C1	C2	H21	90.0°	109.1°
C1	C2	H22	90.0°	109.1°
H11	C1	H12	90.0°	108.1°
H11	C1	H13A	90.0°	108.1°
H12	C1	H13A	90.0°	108.3°
C3	C2	H21	90.0°	109.9°
C3	C2	H22	90.0°	109.9°
C2	C3	C4	67.2°	111.2°
C2	C3	H31	127.0°	109.5°
C2	C3	H32	132.2°	109.2°
H21	C2	H22	90.0°	107.2°
C4	C3	H31	127.0°	109.6°
C4	C3	H32	132.2°	110.0°
C3	C4	C5	124.6°	112.6°
C3	C4	H41	104.7°	109.0°
C3	C4	H42	101.2°	109.5°
H31	C3	H32	80.0°	107.2°
C5	C4	H41	104.7°	108.4°
C5	C4	H42	101.1°	110.2°
C4	C5	C6	121.0°	112.4°
C4	C5	H51	105.8°	111.1°
C4	C5	H52	103.1°	109.9°
H41	C4	H42	122.3°	107.0°
C6	C5	H51	105.8°	108.6°
C6	C5	H52	103.1°	108.4°
C5	C6	C7	118.7°	116.6°
C5	C6	O4	119.7°	121.3°
H51	C5	H52	119.1°	106.2°
C7	C6	O4	121.6°	122.1°
C6	C7	C8	112.4°	120.8°
C6	C7	H7	123.8°	117.7°
C8	C7	H7	123.8°	121.5°
C7	C8	C9	111.4°	123.4°
C7	C8	H8	124.3°	120.6°
C9	C8	H8	124.3°	116.1°
C8	C9	C10	117.2°	113.8°
C8	C9	C13	113.0°	113.9°
C8	C9	H9	95.0°	107.8°
C10	C9	C13	32.9°	104.0°
C10	C9	H9	143.2°	108.2°
C9	C10	O1	90.0°	112.2°
C9	C10	C11	90.0°	104.3°
C9	C10	H10	90.0°	112.0°
C13	C9	H9	147.0°	109.0°
C9	C13	C12	146.3°	101.1°
C9	C13	C14	112.1°	113.4°
C9	C13	H13	80.1°	111.4°
O1	C10	C11	90.0°	109.6°
O1	C10	H10	90.0°	107.4°
C10	O1	HO1	90.0°	106.5°
C11	C10	H10	90.0°	111.3°
C10	C11	C12	90.0°	102.2°
C10	C11	H111	90.0°	111.4°
C10	C11	H112	90.0°	112.7°
C12	C11	H111	90.0°	108.2°
C12	C11	H112	90.0°	110.3°
C11	C12	O2	90.0°	123.4°
C11	C12	C13	90.0°	112.3°
H111	C11	H112	90.0°	111.6°
O2	C12	C13	90.0°	124.3°
C12	C13	C14	63.4°	112.2°
C12	C13	H13	120.4°	107.9°
C14	C13	H13	151.8°	110.4°
C13	C14	C15	115.3°	116.9°
C13	C14	H141	107.5°	108.8°
C13	C14	H142	106.2°	108.5°
C15	C14	H141	107.6°	107.9°
C15	C14	H142	106.2°	107.7°
C14	C15	C16	90.0°	127.1°
C14	C15	H15	90.0°	114.8°
H141	C14	H142	114.2°	106.5°
C16	C15	H15	90.0°	118.1°
C15	C16	C17	90.0°	123.7°
C15	C16	H16	90.0°	120.2°
C17	C16	H16	90.0°	116.1°
C16	C17	C18	90.0°	113.7°
C16	C17	H171	90.0°	107.8°
C16	C17	H172	90.0°	111.0°
C18	C17	H171	90.0°	108.4°
C18	C17	H172	90.0°	109.4°
C17	C18	C19	90.0°	114.0°
C17	C18	H181	90.0°	107.2°
C17	C18	H182	90.0°	110.1°
H171	C17	H172	90.0°	106.2°
C19	C18	H181	90.0°	107.8°
C19	C18	H182	90.0°	111.0°
C18	C19	C20	90.0°	113.8°
C18	C19	H191	90.0°	109.0°
C18	C19	H192	90.0°	109.6°
H181	C18	H182	90.0°	106.5°
C20	C19	H191	90.0°	106.4°
C20	C19	H192	90.0°	109.6°
C19	C20	O3	90.0°	111.7°
C19	C20	O5	90.0°	125.4°
H191	C19	H192	90.0°	108.2°
O3	C20	O5	90.0°	122.9°
C20	O3	HO3	90.0°	115.2°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C2	C1	H11	H12	90.0°	121.5°
C2	C1	H11	H13A	90.0°	121.5°
C2	C1	H12	H13A	90.0°	122.0°
C1	C2	C3	H21	90.0°	121.1°
C1	C2	C3	H22	90.0°	121.1°
C1	C2	H21	H22	90.0°	118.0°
C1	C2	C3	C4	90.0°	178.7°
C1	C2	C3	H31	90.0°	60.0°
C1	C2	C3	H32	90.0°	57.1°
H11	C1	H12	H13A	90.0°	116.9°
H11	C1	C2	C3	90.0°	179.9°
H11	C1	C2	H21	90.0°	58.6°
H11	C1	C2	H22	90.0°	58.3°
H12	C1	C2	C3	90.0°	60.4°
H12	C1	C2	H21	90.0°	61.2°
H12	C1	C2	H22	90.0°	178.0°
H13A	C1	C2	C3	90.0°	60.1°
H13A	C1	C2	H21	90.0°	178.4°
H13A	C1	C2	H22	90.0°	61.5°
C3	C2	H21	H22	90.0°	119.4°
C2	C3	C4	H31	120.0°	121.3°
C2	C3	C4	H32	127.1°	121.1°
C2	C3	H31	H32	136.2°	118.4°
C2	C3	C4	C5	64.7°	178.7°
C2	C3	C4	H41	55.3°	61.0°
C2	C3	C4	H42	176.7°	55.8°
H21	C2	C3	C4	90.0°	57.6°
H21	C2	C3	H31	90.0°	178.9°
H21	C2	C3	H32	90.0°	64.0°
H22	C2	C3	C4	90.0°	60.2°
H22	C2	C3	H31	90.0°	61.2°
H22	C2	C3	H32	90.0°	178.3°
C4	C3	H31	H32	136.2°	119.3°
C3	C4	C5	H41	120.0°	120.7°
C3	C4	C5	H42	112.0°	122.5°
C3	C4	H41	H42	113.8°	118.4°
C3	C4	C5	C6	179.9°	179.4°
C3	C4	C5	H51	60.0°	57.4°
C3	C4	C5	H52	65.8°	59.8°
H31	C3	C4	C5	175.3°	60.0°
H31	C3	C4	H41	64.7°	60.3°
H31	C3	C4	H42	63.3°	177.1°
H32	C3	C4	C5	62.4°	57.6°
H32	C3	C4	H41	177.7°	177.9°
H32	C3	C4	H42	49.7°	65.3°
C5	C4	H41	H42	113.7°	118.8°
C4	C5	C6	H51	120.0°	123.3°
C4	C5	C6	H52	114.3°	121.7°
C4	C5	H51	H52	115.2°	119.5°
C4	C5	C6	C7	179.6°	176.7°
C4	C5	C6	O4	0.1°	2.8°
H41	C4	C5	C6	60.0°	60.0°
H41	C4	C5	H51	180.0°	178.1°
H41	C4	C5	H52	54.2°	60.8°
H42	C4	C5	C6	67.9°	56.8°
H42	C4	C5	H51	52.1°	65.1°
H42	C4	C5	H52	177.8°	177.6°
C6	C5	H51	H52	115.2°	116.4°
C5	C6	C7	O4	179.5°	179.5°
C5	C6	C7	C8	60.0°	179.7°
C5	C6	C7	H7	120.0°	0.0°
H51	C5	C6	C7	59.6°	59.9°
H51	C5	C6	O4	119.9°	120.5°
H52	C5	C6	C7	66.1°	55.0°
H52	C5	C6	O4	114.3°	124.5°
C6	C7	C8	H7	180.0°	179.7°
C6	C7	C8	C9	179.7°	179.7°
C6	C7	C8	H8	0.3°	0.2°
O4	C6	C7	C8	120.4°	0.2°
O4	C6	C7	H7	59.6°	179.5°
C7	C8	C9	H8	180.0°	179.9°
C7	C8	C9	C10	143.9°	120.0°
C7	C8	C9	C13	179.9°	121.0°
C7	C8	C9	H9	17.7°	0.0°
H7	C7	C8	C9	0.3°	0.0°
H7	C7	C8	H8	179.7°	179.9°
C8	C9	C10	C13	90.8°	124.5°
C8	C9	C10	H9	148.4°	119.8°
C8	C9	C13	H9	146.1°	120.3°
C8	C9	C10	O1	90.0°	47.2°
C8	C9	C10	C11	90.0°	165.7°
C8	C9	C10	H10	90.0°	73.7°
C8	C9	C13	C12	105.0°	157.7°
C8	C9	C13	C14	179.9°	82.0°
C8	C9	C13	H13	26.6°	43.3°
H8	C8	C9	C10	36.1°	60.1°
H8	C8	C9	C13	0.0°	58.9°
H8	C8	C9	H9	162.3°	179.9°
C10	C9	C13	H9	108.9°	115.2°
C9	C10	O1	C11	90.0°	115.3°
C9	C10	O1	H10	90.0°	123.6°
C9	C10	C11	H10	90.0°	121.0°
C9	C10	O1	HO1	90.0°	173.8°
C9	C10	C11	C12	90.0°	30.9°
C9	C10	C11	H111	90.0°	84.4°
C9	C10	C11	H112	90.0°	149.3°
C10	C9	C13	C12	0.0°	33.3°
C10	C9	C13	C14	74.9°	153.6°
C10	C9	C13	H13	131.6°	81.2°
C13	C9	C10	O1	90.0°	77.3°
C13	C9	C10	C11	90.0°	41.3°
C13	C9	C10	H10	90.0°	161.8°
C9	C13	C12	C11	90.0°	14.5°
C9	C13	C12	O2	90.0°	165.5°
C9	C13	C12	C14	90.5°	121.2°
C9	C13	C12	H13	121.4°	117.0°
C9	C13	C14	H13	111.4°	125.8°
C9	C13	C14	C15	143.3°	68.6°
C9	C13	C14	H141	23.3°	53.8°
C9	C13	C14	H142	99.4°	169.4°
H9	C9	C10	O1	90.0°	167.0°
H9	C9	C10	C11	90.0°	74.5°
H9	C9	C10	H10	90.0°	46.0°
H9	C9	C13	C12	108.9°	81.9°
H9	C9	C13	C14	34.0°	38.4°
H9	C9	C13	H13	119.4°	163.6°
O1	C10	C11	H10	90.0°	118.7°
O1	C10	C11	C12	90.0°	89.4°
O1	C10	C11	H111	90.0°	155.3°
O1	C10	C11	H112	90.0°	29.0°
C11	C10	O1	HO1	90.0°	58.5°
C10	C11	C12	H111	90.0°	117.6°
C10	C11	C12	H112	90.0°	120.1°
C10	C11	H111	H112	90.0°	126.9°
C10	C11	C12	O2	90.0°	169.9°
C10	C11	C12	C13	90.0°	10.1°
H10	C10	O1	HO1	90.0°	62.6°
H10	C10	C11	C12	90.0°	151.9°
H10	C10	C11	H111	90.0°	36.6°
H10	C10	C11	H112	90.0°	89.7°
C12	C11	H111	H112	90.0°	121.5°
C11	C12	O2	C13	90.0°	180.0°
C11	C12	C13	C14	90.0°	135.7°
C11	C12	C13	H13	90.0°	102.6°
H111	C11	C12	O2	90.0°	72.5°
H111	C11	C12	C13	90.0°	107.5°
H112	C11	C12	O2	90.0°	49.8°
H112	C11	C12	C13	90.0°	130.2°
O2	C12	C13	C14	90.0°	44.3°
O2	C12	C13	H13	90.0°	77.5°
C12	C13	C14	H13	105.3°	120.3°
C12	C13	C14	C15	NaN°	177.6°
C12	C13	C14	H141	120.0°	60.0°
C12	C13	C14	H142	117.4°	55.5°
C13	C14	C15	H141	120.0°	122.9°
C13	C14	C15	H142	117.3°	122.4°
C13	C14	H141	H142	117.6°	116.8°
C13	C14	C15	C16	90.0°	27.1°
C13	C14	C15	H15	90.0°	153.4°
H13	C13	C14	C15	105.3°	57.2°
H13	C13	C14	H141	134.6°	179.7°
H13	C13	C14	H142	12.0°	64.8°
C15	C14	H141	H142	117.6°	115.4°
C14	C15	C16	H15	90.0°	179.4°
C14	C15	C16	C17	90.0°	179.5°
C14	C15	C16	H16	90.0°	0.8°
H141	C14	C15	C16	90.0°	150.0°
H141	C14	C15	H15	90.0°	30.5°
H142	C14	C15	C16	90.0°	95.3°
H142	C14	C15	H15	90.0°	84.1°
C15	C16	C17	H16	90.0°	179.8°
C15	C16	C17	C18	90.0°	119.8°
C15	C16	C17	H171	90.0°	120.0°
C15	C16	C17	H172	90.0°	4.0°
H15	C15	C16	C17	90.0°	0.0°
H15	C15	C16	H16	90.0°	179.8°
C16	C17	C18	H171	90.0°	119.9°
C16	C17	C18	H172	90.0°	124.7°
C16	C17	H171	H172	90.0°	119.1°
C16	C17	C18	C19	90.0°	179.2°
C16	C17	C18	H181	90.0°	60.0°
C16	C17	C18	H182	90.0°	55.4°
H16	C16	C17	C18	90.0°	60.5°
H16	C16	C17	H171	90.0°	59.8°
H16	C16	C17	H172	90.0°	175.7°
C18	C17	H171	H172	90.0°	117.4°
C17	C18	C19	H181	90.0°	118.8°
C17	C18	C19	H182	90.0°	125.0°
C17	C18	H181	H182	90.0°	117.8°
C17	C18	C19	C20	90.0°	61.2°
C17	C18	C19	H191	90.0°	179.7°
C17	C18	C19	H192	90.0°	62.0°
H171	C17	C18	C19	90.0°	59.3°
H171	C17	C18	H181	90.0°	59.9°
H171	C17	C18	H182	90.0°	175.3°
H172	C17	C18	C19	90.0°	56.1°
H172	C17	C18	H181	90.0°	175.3°
H172	C17	C18	H182	90.0°	69.3°
C19	C18	H181	H182	90.0°	119.1°
C18	C19	C20	H191	90.0°	120.0°
C18	C19	C20	H192	90.0°	123.1°
C18	C19	H191	H192	90.0°	119.2°
C18	C19	C20	O3	90.0°	152.0°
C18	C19	C20	O5	90.0°	30.0°
H181	C18	C19	C20	90.0°	180.0°
H181	C18	C19	H191	90.0°	61.4°
H181	C18	C19	H192	90.0°	56.8°
H182	C18	C19	C20	90.0°	63.8°
H182	C18	C19	H191	90.0°	54.8°
H182	C18	C19	H192	90.0°	173.0°
C20	C19	H191	H192	90.0°	117.8°
C19	C20	O3	O5	90.0°	178.1°
C19	C20	O3	HO3	90.0°	178.1°
H191	C19	C20	O3	90.0°	88.0°
H191	C19	C20	O5	90.0°	90.0°
H192	C19	C20	O3	90.0°	28.8°
H192	C19	C20	O5	90.0°	153.2°
O5	C20	O3	HO3	90.0°	0.0°

Definition date:	2003-11-11
Last modified:	2020-06-17
Release status:	REL
Processing site:	RCSB
Derived from:	1V3V