A1EO2

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C10	C06	doub	1.33Å	1.35Å
O08	C07	doub	1.22Å	1.41Å
C06	C07	sing	1.47Å	1.50Å
C06	C05	sing	1.51Å	1.52Å
C07	O09	sing	1.35Å	1.27Å
C05	C04	sing	1.53Å	1.56Å
F17	C16	sing	1.40Å	1.42Å
C16	C15	sing	1.53Å	1.59Å
C15	O14	sing	1.43Å	1.35Å
C04	C11	sing	1.51Å	1.54Å
C04	O03	sing	1.43Å	1.43Å
C12	C11	doub	1.38Å	1.44Å	Aromatic
C12	C13	sing	1.39Å	1.42Å	Aromatic
O14	C13	sing	1.36Å	1.39Å
C11	C20	sing	1.40Å	1.33Å	Aromatic
O03	B02	sing	1.42Å	1.47Å
C13	C18	doub	1.39Å	1.36Å	Aromatic
C20	B02	sing	1.57Å	1.53Å
C20	C19	doub	1.39Å	1.43Å	Aromatic
B02	O01	sing	1.42Å	1.36Å
C18	C19	sing	1.38Å	1.42Å	Aromatic
C10	H1	sing	1.08Å	1.08Å
C10	H2	sing	1.08Å	1.08Å
C15	H3	sing	1.09Å	1.10Å
C15	H4	sing	1.09Å	1.10Å
O01	H5	sing	0.97Å	0.95Å
C04	H6	sing	1.09Å	1.10Å
C05	H7	sing	1.09Å	1.10Å
C05	H8	sing	1.09Å	1.10Å
O09	H9	sing	0.97Å	0.95Å
C12	H10	sing	1.08Å	1.08Å
C16	H11	sing	1.09Å	1.10Å
C16	H12	sing	1.09Å	1.10Å
C18	H13	sing	1.08Å	1.08Å
C19	H14	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C10	C06	C07	118.7°	120.0°
C10	C06	C05	121.5°	120.0°
C06	C10	H1	120.0°	120.0°
C06	C10	H2	120.0°	120.0°
O08	C07	C06	117.5°	120.0°
O08	C07	O09	121.7°	120.0°
C07	C06	C05	119.8°	120.0°
C06	C07	O09	120.8°	120.0°
C06	C05	C04	113.0°	109.5°
C06	C05	H7	108.6°	109.5°
C06	C05	H8	108.6°	109.5°
C07	O09	H9	109.5°	117.0°
C05	C04	C11	107.6°	109.5°
C05	C04	O03	113.9°	109.5°
C05	C04	H6	108.9°	109.5°
C04	C05	H7	108.6°	109.5°
C04	C05	H8	108.6°	109.5°
F17	C16	C15	107.6°	109.5°
F17	C16	H11	110.0°	109.5°
F17	C16	H12	110.0°	109.5°
C16	C15	O14	109.0°	109.5°
C16	C15	H3	109.6°	109.5°
C16	C15	H4	109.6°	109.5°
C15	C16	H11	109.9°	109.5°
C15	C16	H12	110.0°	109.5°
C15	O14	C13	115.0°	117.0°
O14	C15	H3	109.6°	109.5°
O14	C15	H4	109.6°	109.4°
C11	C04	O03	106.5°	109.4°
C04	C11	C12	130.6°	132.4°
C04	C11	C20	109.9°	107.9°
C11	C04	H6	109.1°	109.5°
C04	O03	B02	108.1°	108.9°
O03	C04	H6	110.7°	109.5°
C11	C12	C13	120.0°	120.0°
C12	C11	C20	119.5°	119.7°
C11	C12	H10	120.0°	120.0°
C12	C13	O14	120.4°	119.8°
C12	C13	C18	119.7°	120.2°
C13	C12	H10	120.0°	120.0°
O14	C13	C18	119.9°	119.9°
C11	C20	B02	108.5°	106.9°
C11	C20	C19	121.0°	120.2°
O03	B02	C20	106.7°	107.0°
O03	B02	O01	107.9°	126.5°
C13	C18	C19	120.2°	120.0°
C13	C18	H13	119.9°	120.0°
B02	C20	C19	130.4°	132.9°
C20	B02	O01	119.1°	126.5°
C20	C19	C18	119.4°	119.8°
C20	C19	H14	120.3°	120.1°
B02	O01	H5	109.5°	114.0°
C19	C18	H13	119.9°	120.0°
C18	C19	H14	120.3°	120.1°
H1	C10	H2	120.0°	120.1°
H3	C15	H4	109.5°	109.5°
H7	C05	H8	109.5°	109.5°
H11	C16	H12	109.4°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C10	C06	C07	O08	18.2°	0.0°
C10	C06	C07	C05	178.3°	180.0°
C10	C06	C07	O09	158.8°	180.0°
C10	C06	C05	C04	79.9°	95.0°
C06	C10	H1	H2	180.0°	179.8°
C10	C06	C05	H7	159.6°	25.0°
C10	C06	C05	H8	40.7°	145.0°
O08	C07	C06	O09	177.0°	180.0°
O08	C07	C06	C05	163.4°	180.0°
O08	C07	O09	H9	0.0°	0.0°
C07	C06	C05	C04	98.4°	85.1°
C07	C06	C10	H1	178.3°	180.0°
C07	C06	C10	H2	1.7°	0.2°
C07	C06	C05	H7	22.1°	155.0°
C07	C06	C05	H8	141.0°	35.0°
C06	C07	O09	H9	176.9°	180.0°
C05	C06	C07	O09	19.5°	0.0°
C06	C05	C04	H7	120.5°	120.0°
C06	C05	C04	H8	120.5°	120.0°
C06	C05	C04	C11	173.1°	175.0°
C06	C05	C04	O03	69.0°	65.1°
C05	C06	C10	H1	0.0°	0.0°
C05	C06	C10	H2	180.0°	179.7°
C06	C05	C04	H6	55.0°	54.9°
C06	C05	H7	H8	118.4°	120.0°
C05	C04	C11	O03	122.5°	120.0°
C05	C04	C11	H6	117.9°	120.0°
C05	C04	O03	H6	123.1°	120.0°
C05	C04	C11	C12	53.6°	60.0°
C05	C04	C11	C20	127.6°	119.9°
C05	C04	O03	B02	123.6°	120.0°
C04	C05	H7	H8	118.4°	120.0°
F17	C16	C15	H11	119.7°	120.0°
F17	C16	C15	H12	119.7°	120.0°
F17	C16	C15	O14	67.0°	65.0°
F17	C16	C15	H3	53.0°	55.0°
F17	C16	C15	H4	173.1°	175.0°
F17	C16	H11	H12	120.9°	120.0°
C16	C15	O14	H3	119.9°	120.0°
C16	C15	O14	H4	119.9°	120.0°
C16	C15	O14	C13	170.6°	180.0°
C16	C15	H3	H4	120.2°	120.0°
C15	C16	H11	H12	120.9°	120.0°
C15	O14	C13	C12	29.9°	179.7°
C15	O14	C13	C18	149.7°	0.0°
O14	C15	H3	H4	120.2°	120.0°
O14	C15	C16	H11	173.3°	174.9°
O14	C15	C16	H12	52.8°	55.0°
C11	C04	O03	H6	118.5°	120.0°
C04	C11	C12	C20	178.7°	179.9°
C04	C11	C12	C13	179.7°	180.0°
C11	C04	O03	B02	5.2°	0.0°
C04	C11	C20	B02	2.7°	0.1°
C04	C11	C20	C19	179.4°	180.0°
C11	C04	C05	H7	66.3°	55.0°
C11	C04	C05	H8	52.6°	65.0°
C04	C11	C12	H10	0.3°	0.1°
O03	C04	C11	C12	176.1°	179.9°
O03	C04	C11	C20	5.1°	0.1°
C04	O03	B02	C20	3.8°	0.0°
C04	O03	B02	O01	132.9°	180.0°
O03	C04	C05	H7	51.5°	174.9°
O03	C04	C05	H8	170.4°	54.9°
C11	C12	C13	H10	180.0°	179.9°
C11	C12	C13	O14	179.3°	179.6°
C11	C12	C13	C18	0.3°	0.1°
C12	C11	C20	B02	178.3°	180.0°
C12	C11	C20	C19	1.6°	0.1°
C12	C11	C04	H6	64.4°	60.1°
C12	C13	O14	C18	179.5°	179.7°
C13	C12	C11	C20	1.0°	0.1°
C12	C13	C18	C19	0.2°	0.0°
C12	C13	C18	H13	179.8°	180.0°
O14	C13	C18	C19	179.3°	179.7°
C13	O14	C15	H3	69.5°	60.0°
C13	O14	C15	H4	50.7°	60.0°
O14	C13	C12	H10	0.7°	0.2°
O14	C13	C18	H13	0.7°	0.3°
C11	C20	B02	O03	0.6°	0.0°
C11	C20	B02	C19	176.3°	180.0°
C11	C20	B02	O01	122.9°	180.0°
C11	C20	C19	C18	1.6°	0.0°
C20	C11	C04	H6	114.5°	120.0°
C20	C11	C12	H10	179.0°	180.0°
C11	C20	C19	H14	178.5°	179.9°
O03	B02	C20	O01	122.3°	180.0°
O03	B02	C20	C19	175.7°	180.0°
O03	B02	O01	H5	0.0°	0.0°
B02	O03	C04	H6	113.3°	120.0°
C13	C18	C19	C20	0.8°	0.1°
C13	C18	C19	H13	180.0°	180.0°
C18	C13	C12	H10	179.8°	179.9°
C13	C18	C19	H14	179.2°	180.0°
B02	C20	C19	C18	177.5°	179.9°
C20	B02	O01	H5	121.7°	180.0°
B02	C20	C19	H14	2.5°	0.0°
C19	C20	B02	O01	53.4°	0.0°
C20	C19	C18	H14	180.0°	179.9°
C20	C19	C18	H13	179.2°	180.0°
H3	C15	C16	H11	66.8°	65.0°
H3	C15	C16	H12	172.7°	175.0°
H4	C15	C16	H11	53.4°	55.0°
H4	C15	C16	H12	67.2°	65.0°
H6	C04	C05	H7	175.5°	65.0°
H6	C04	C05	H8	65.5°	175.0°
H13	C18	C19	H14	0.8°	0.1°

Release date:	2026-04-15
Definition date:	2025-04-11
Last modified:	2026-04-10
Release status:	REL
Processing site:	PDBC
Derived from:	9UE4