F8O

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C51	C50	sing	1.53Å	1.51Å
C50	C49	sing	1.53Å	1.52Å
C49	C46	sing	1.53Å	1.53Å
C46	C45	sing	1.53Å	1.51Å
C44	C45	sing	1.53Å	1.53Å
C44	C43	sing	1.53Å	1.53Å
C52	C43	sing	1.53Å	1.53Å
C45	C53	sing	1.53Å	1.52Å
C43	C42	sing	1.51Å	1.52Å
O47	C42	doub	1.21Å	1.23Å
C43	H2	sing	1.09Å	1.10Å
C44	H3	sing	1.09Å	1.10Å
C44	H4	sing	1.09Å	1.10Å
C45	H5	sing	1.09Å	1.10Å
C46	H6	sing	1.09Å	1.10Å
C46	H7	sing	1.09Å	1.10Å
C49	H8	sing	1.09Å	1.10Å
C49	H9	sing	1.09Å	1.10Å
C50	H10	sing	1.09Å	1.10Å
C50	H11	sing	1.09Å	1.10Å
C51	H12	sing	1.09Å	1.10Å
C51	H13	sing	1.09Å	1.10Å
C51	H14	sing	1.09Å	1.10Å
C52	H15	sing	1.09Å	1.10Å
C52	H16	sing	1.09Å	1.10Å
C52	H17	sing	1.09Å	1.10Å
C53	H18	sing	1.09Å	1.10Å
C53	H19	sing	1.09Å	1.10Å
C53	H20	sing	1.09Å	1.10Å
C42	OXT	sing	1.34Å	23.86Å
OXT	HXT	sing	0.97Å	0.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C51	C50	C49	115.3°	109.4°
C51	C50	H10	108.0°	109.4°
C51	C50	H11	108.0°	109.4°
C50	C51	H12	109.5°	109.5°
C50	C51	H13	109.4°	109.4°
C50	C51	H14	109.4°	109.4°
C50	C49	C46	115.2°	109.4°
C50	C49	H8	108.0°	109.5°
C50	C49	H9	108.0°	109.5°
C49	C50	H10	108.0°	109.6°
C49	C50	H11	108.0°	109.5°
C49	C46	C45	113.9°	109.4°
C49	C46	H6	108.3°	109.5°
C49	C46	H7	108.4°	109.4°
C46	C49	H8	108.0°	109.5°
C46	C49	H9	108.0°	109.4°
C46	C45	C44	112.8°	109.4°
C46	C45	C53	111.1°	109.5°
C46	C45	H5	107.3°	109.5°
C45	C46	H6	108.3°	109.6°
C45	C46	H7	108.3°	109.5°
C45	C44	C43	114.5°	109.5°
C44	C45	C53	111.0°	109.5°
C45	C44	H3	108.2°	109.4°
C45	C44	H4	108.2°	109.5°
C44	C45	H5	107.1°	109.4°
C44	C43	C52	109.2°	109.4°
C44	C43	C42	112.8°	109.5°
C44	C43	H2	108.5°	109.5°
C43	C44	H3	108.2°	109.4°
C43	C44	H4	108.2°	109.5°
C52	C43	C42	109.4°	109.5°
C52	C43	H2	108.4°	109.5°
C43	C52	H15	109.5°	109.4°
C43	C52	H16	109.5°	109.5°
C43	C52	H17	109.5°	109.5°
C53	C45	H5	107.2°	109.5°
C45	C53	H18	109.5°	109.4°
C45	C53	H19	109.5°	109.5°
C45	C53	H20	109.4°	109.5°
C43	C42	O47	118.2°	120.0°
C42	C43	H2	108.5°	109.5°
C43	C42	OXT	67.7°	120.0°
O47	C42	OXT	101.7°	120.0°
H3	C44	H4	109.5°	109.5°
H6	C46	H7	109.5°	109.5°
H8	C49	H9	109.5°	109.5°
H10	C50	H11	109.5°	109.5°
H12	C51	H13	109.5°	109.5°
H12	C51	H14	109.5°	109.4°
H13	C51	H14	109.5°	109.5°
H15	C52	H16	109.5°	109.5°
H15	C52	H17	109.5°	109.5°
H16	C52	H17	109.5°	109.5°
H18	C53	H19	109.4°	109.5°
H18	C53	H20	109.5°	109.5°
H19	C53	H20	109.5°	109.5°
C42	OXT	HXT	90.0°	117.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C51	C50	C49	H10	120.9°	120.0°
C51	C50	C49	H11	120.9°	119.9°
C51	C50	C49	C46	131.6°	180.0°
C51	C50	C49	H8	10.7°	60.0°
C51	C50	C49	H9	107.6°	60.1°
C51	C50	H10	H11	117.4°	119.9°
C50	C51	H12	H13	120.0°	120.0°
C50	C51	H12	H14	120.0°	120.0°
C50	C51	H13	H14	120.0°	120.0°
C50	C49	C46	H8	120.8°	120.0°
C50	C49	C46	H9	120.9°	119.9°
C50	C49	C46	C45	114.0°	180.0°
C50	C49	C46	H6	6.6°	59.9°
C50	C49	C46	H7	125.3°	60.1°
C50	C49	H8	H9	117.4°	120.0°
C49	C50	H10	H11	117.3°	120.0°
C49	C50	C51	H12	180.0°	60.0°
C49	C50	C51	H13	60.0°	60.0°
C49	C50	C51	H14	60.0°	179.9°
C49	C46	C45	H6	120.7°	120.0°
C49	C46	C45	H7	120.7°	119.9°
C49	C46	C45	C44	48.0°	175.0°
C49	C46	C45	C53	173.4°	65.0°
C49	C46	C45	H5	69.8°	55.1°
C49	C46	H6	H7	118.0°	120.0°
C46	C49	H8	H9	117.4°	120.0°
C46	C49	C50	H10	107.6°	60.0°
C46	C49	C50	H11	10.7°	60.1°
C46	C45	C44	C53	125.4°	120.0°
C46	C45	C44	H5	117.8°	120.0°
C46	C45	C44	C43	160.1°	65.3°
C46	C45	C53	H5	116.9°	120.0°
C46	C45	C44	H3	39.3°	54.6°
C46	C45	C44	H4	79.2°	174.6°
C45	C46	H6	H7	117.9°	120.0°
C45	C46	C49	H8	125.1°	60.0°
C45	C46	C49	H9	6.8°	60.1°
C46	C45	C53	H18	180.0°	173.0°
C46	C45	C53	H19	60.0°	67.1°
C46	C45	C53	H20	60.0°	53.0°
C45	C44	C43	H3	120.8°	120.0°
C45	C44	C43	H4	120.8°	120.1°
C45	C44	C43	C52	156.6°	65.8°
C44	C45	C53	H5	116.7°	120.0°
C45	C44	C43	C42	81.6°	174.2°
C45	C44	C43	H2	38.6°	54.2°
C45	C44	H3	H4	117.7°	120.0°
C44	C45	C46	H6	168.6°	55.0°
C44	C45	C46	H7	72.7°	65.1°
C44	C45	C53	H18	53.6°	53.0°
C44	C45	C53	H19	173.6°	173.0°
C44	C45	C53	H20	66.4°	67.0°
C44	C43	C52	C42	123.8°	120.0°
C44	C43	C52	H2	118.0°	120.0°
C43	C44	C45	C53	34.6°	174.6°
C44	C43	C42	H2	120.2°	120.0°
C44	C43	C42	O47	42.3°	0.2°
C43	C44	H3	H4	117.7°	120.0°
C43	C44	C45	H5	82.2°	54.6°
C44	C43	C52	H15	180.0°	179.9°
C44	C43	C52	H16	60.0°	60.1°
C44	C43	C52	H17	60.0°	59.8°
C44	C43	C42	OXT	49.4°	180.0°
C52	C43	C42	H2	118.1°	120.0°
C52	C43	C42	O47	79.4°	120.2°
C52	C43	C44	H3	35.8°	174.3°
C52	C43	C44	H4	82.6°	54.3°
C43	C52	H15	H16	120.0°	120.0°
C43	C52	H15	H17	120.0°	120.0°
C43	C52	H16	H17	120.0°	120.0°
C52	C43	C42	OXT	171.1°	60.0°
C53	C45	C44	H3	86.1°	65.4°
C53	C45	C44	H4	155.4°	54.6°
C53	C45	C46	H6	66.0°	175.0°
C53	C45	C46	H7	52.7°	54.9°
C45	C53	H18	H19	120.0°	120.0°
C45	C53	H18	H20	120.0°	120.0°
C45	C53	H19	H20	120.0°	120.1°
C43	C42	O47	OXT	70.8°	179.8°
C42	C43	C44	H3	157.7°	54.2°
C42	C43	C44	H4	39.2°	65.7°
C42	C43	C52	H15	56.2°	59.8°
C42	C43	C52	H16	176.1°	179.8°
C42	C43	C52	H17	63.9°	60.2°
C43	C42	OXT	HXT	90.0°	180.0°
O47	C42	C43	H2	162.5°	119.8°
O47	C42	OXT	HXT	90.0°	0.3°
H2	C43	C44	H3	82.1°	65.8°
H2	C43	C44	H4	159.4°	174.3°
H2	C43	C52	H15	62.0°	60.2°
H2	C43	C52	H16	58.0°	59.8°
H2	C43	C52	H17	178.0°	179.8°
H2	C43	C42	OXT	70.8°	60.0°
H3	C44	C45	H5	157.1°	174.6°
H4	C44	C45	H5	38.6°	65.5°
H5	C45	C46	H6	50.9°	65.0°
H5	C45	C46	H7	169.6°	175.0°
H5	C45	C53	H18	63.1°	67.0°
H5	C45	C53	H19	56.9°	53.0°
H5	C45	C53	H20	176.9°	173.0°
H6	C46	C49	H8	114.2°	179.9°
H6	C46	C49	H9	127.5°	60.0°
H7	C46	C49	H8	4.5°	60.0°
H7	C46	C49	H9	113.8°	180.0°
H8	C49	C50	H10	131.6°	180.0°
H8	C49	C50	H11	110.2°	59.9°
H9	C49	C50	H10	13.3°	59.9°
H9	C49	C50	H11	131.5°	180.0°
H10	C50	C51	H12	59.2°	179.9°
H10	C50	C51	H13	60.8°	60.1°
H10	C50	C51	H14	179.2°	60.0°
H11	C50	C51	H12	59.1°	60.0°
H11	C50	C51	H13	179.2°	180.0°
H11	C50	C51	H14	60.9°	60.0°
H12	C51	H13	H14	120.0°	120.0°
H15	C52	H16	H17	120.0°	120.1°
H18	C53	H19	H20	120.0°	120.0°

Release date:	2024-05-08
Definition date:	2023-07-19
Last modified:	2024-09-27
Release status:	REL
Processing site:	PDBE
Derived from:	8PQO