5EU

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O01	C02	sing	1.36Å	1.46Å
C22	C02	doub	1.39Å	1.33Å	Aromatic
C22	C20	sing	1.38Å	1.37Å	Aromatic
C02	C03	sing	1.39Å	1.43Å	Aromatic
CL2	C20	sing	1.74Å	1.73Å
C20	C05	doub	1.40Å	1.34Å	Aromatic
C03	C04	doub	1.38Å	1.32Å	Aromatic
C05	C04	sing	1.40Å	1.39Å	Aromatic
C05	C06	sing	1.48Å	1.50Å
C06	C07	doub	1.35Å	1.47Å	Aromatic
C06	S19	sing	1.76Å	1.61Å	Aromatic
C07	C08	sing	1.38Å	1.50Å	Aromatic
S19	C10	sing	1.76Å	1.63Å	Aromatic
C08	C10	doub	1.35Å	1.46Å	Aromatic
C08	C09	sing	1.51Å	1.44Å
CL1	C12	sing	1.74Å	1.77Å
C10	C11	sing	1.48Å	1.54Å
C11	C12	doub	1.40Å	1.33Å	Aromatic
C11	C18	sing	1.40Å	1.39Å	Aromatic
C12	C14	sing	1.38Å	1.37Å	Aromatic
C14	C15	doub	1.39Å	1.35Å	Aromatic
C18	C17	doub	1.38Å	1.40Å	Aromatic
C15	C17	sing	1.39Å	1.35Å	Aromatic
C15	O16	sing	1.36Å	1.34Å
O01	H1	sing	0.97Å	0.95Å
C03	H2	sing	1.08Å	1.08Å
C04	H3	sing	1.08Å	1.08Å
C07	H4	sing	1.08Å	1.08Å
C09	H5	sing	1.09Å	1.10Å
C09	H6	sing	1.09Å	1.10Å
C09	H7	sing	1.09Å	1.10Å
C14	H8	sing	1.08Å	1.08Å
O16	H9	sing	0.97Å	0.95Å
C17	H10	sing	1.08Å	1.08Å
C18	H11	sing	1.08Å	1.08Å
C22	H12	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O01	C02	C22	119.4°	119.9°
O01	C02	C03	121.1°	119.9°
C02	O01	H1	109.5°	114.0°
C02	C22	C20	120.3°	120.1°
C22	C02	C03	119.6°	120.2°
C02	C22	H12	119.8°	120.0°
C22	C20	CL2	120.7°	120.1°
C22	C20	C05	119.9°	119.9°
C20	C22	H12	119.8°	120.0°
C02	C03	C04	119.6°	120.1°
C02	C03	H2	120.2°	119.9°
CL2	C20	C05	119.3°	120.0°
C20	C05	C04	120.6°	119.8°
C20	C05	C06	119.2°	120.1°
C03	C04	C05	119.9°	119.9°
C04	C03	H2	120.2°	120.0°
C03	C04	H3	120.0°	120.0°
C04	C05	C06	120.2°	120.1°
C05	C04	H3	120.1°	120.0°
C05	C06	C07	121.8°	125.2°
C05	C06	S19	127.9°	125.2°
C07	C06	S19	110.3°	109.7°
C06	C07	C08	107.4°	114.8°
C06	C07	H4	126.3°	122.6°
C06	S19	C10	102.1°	91.0°
C07	C08	C10	113.3°	114.8°
C07	C08	C09	121.3°	122.6°
C08	C07	H4	126.3°	122.5°
S19	C10	C08	106.8°	109.7°
S19	C10	C11	131.3°	125.2°
C10	C08	C09	125.4°	122.6°
C08	C10	C11	121.9°	125.2°
C08	C09	H5	109.5°	109.5°
C08	C09	H6	109.4°	109.5°
C08	C09	H7	109.5°	109.5°
CL1	C12	C11	122.4°	120.0°
CL1	C12	C14	115.4°	120.1°
C10	C11	C12	124.3°	120.1°
C10	C11	C18	119.5°	120.1°
C12	C11	C18	116.2°	119.8°
C11	C12	C14	122.2°	119.9°
C11	C18	C17	122.3°	119.9°
C11	C18	H11	118.9°	120.1°
C12	C14	C15	121.3°	120.1°
C12	C14	H8	119.4°	120.0°
C14	C15	C17	119.6°	120.2°
C14	C15	O16	117.5°	119.9°
C15	C14	H8	119.4°	119.9°
C18	C17	C15	118.5°	120.1°
C18	C17	H10	120.7°	119.9°
C17	C18	H11	118.9°	120.0°
C17	C15	O16	122.9°	119.8°
C15	C17	H10	120.8°	120.0°
C15	O16	H9	109.5°	113.9°
H5	C09	H6	109.5°	109.4°
H5	C09	H7	109.5°	109.4°
H6	C09	H7	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O01	C02	C22	C03	179.8°	179.8°
O01	C02	C22	C20	179.3°	179.7°
O01	C02	C03	C04	179.1°	180.0°
O01	C02	C03	H2	0.8°	0.0°
O01	C02	C22	H12	0.6°	0.0°
C02	C22	C20	H12	180.0°	179.7°
C02	C22	C20	CL2	179.4°	179.7°
C02	C22	C20	C05	0.6°	0.5°
C22	C02	C03	C04	0.7°	0.3°
C22	C02	O01	H1	180.0°	90.2°
C22	C02	C03	H2	179.3°	179.7°
C20	C22	C02	C03	0.5°	0.5°
C22	C20	CL2	C05	178.9°	179.7°
C22	C20	C05	C04	0.9°	0.3°
C22	C20	C05	C06	179.1°	179.7°
C02	C03	C04	H2	180.0°	180.0°
C02	C03	C04	C05	1.0°	0.0°
C03	C02	O01	H1	0.2°	90.0°
C02	C03	C04	H3	179.1°	180.0°
C03	C02	C22	H12	179.5°	179.7°
CL2	C20	C05	C04	179.7°	180.0°
CL2	C20	C05	C06	0.2°	0.0°
CL2	C20	C22	H12	0.6°	0.0°
C20	C05	C04	C03	1.1°	0.0°
C20	C05	C04	C06	180.0°	180.0°
C20	C05	C06	C07	97.3°	50.0°
C20	C05	C06	S19	80.7°	129.7°
C20	C05	C04	H3	179.0°	180.0°
C05	C20	C22	H12	179.4°	179.7°
C03	C04	C05	H3	180.0°	180.0°
C03	C04	C05	C06	178.9°	180.0°
C04	C05	C06	C07	82.7°	130.0°
C04	C05	C06	S19	99.2°	50.3°
C05	C04	C03	H2	179.1°	180.0°
C05	C06	C07	S19	178.4°	179.7°
C05	C06	C07	C08	179.7°	180.0°
C05	C06	S19	C10	180.0°	179.9°
C06	C05	C04	H3	1.1°	0.0°
C05	C06	C07	H4	0.4°	0.1°
C06	C07	C08	H4	180.0°	179.9°
C07	C06	S19	C10	1.8°	0.3°
C06	C07	C08	C10	0.2°	0.0°
C06	C07	C08	C09	178.9°	180.0°
S19	C06	C07	C08	1.3°	0.3°
C06	S19	C10	C08	1.6°	0.3°
C06	S19	C10	C11	178.1°	180.0°
S19	C06	C07	H4	178.7°	179.8°
C07	C08	C10	S19	1.0°	0.3°
C07	C08	C10	C09	179.0°	180.0°
C07	C08	C10	C11	178.8°	180.0°
C07	C08	C09	H5	89.5°	94.9°
C07	C08	C09	H6	150.5°	145.1°
C07	C08	C09	H7	30.5°	25.0°
S19	C10	C08	C11	179.8°	179.7°
S19	C10	C08	C09	180.0°	179.7°
S19	C10	C11	C12	39.4°	49.6°
S19	C10	C11	C18	142.0°	130.6°
C08	C10	C11	C12	140.9°	130.7°
C08	C10	C11	C18	37.7°	49.0°
C10	C08	C07	H4	179.9°	179.9°
C10	C08	C09	H5	89.4°	85.1°
C10	C08	C09	H6	30.6°	34.9°
C10	C08	C09	H7	150.6°	155.0°
C09	C08	C10	C11	0.2°	0.0°
C09	C08	C07	H4	1.1°	0.0°
C08	C09	H5	H6	120.0°	120.0°
C08	C09	H5	H7	120.0°	120.0°
C08	C09	H6	H7	120.0°	120.1°
CL1	C12	C11	C10	1.2°	0.0°
CL1	C12	C11	C14	179.5°	180.0°
CL1	C12	C11	C18	179.8°	179.8°
CL1	C12	C14	C15	179.9°	180.0°
CL1	C12	C14	H8	0.1°	0.1°
C10	C11	C12	C18	178.6°	179.8°
C10	C11	C12	C14	179.3°	180.0°
C10	C11	C18	C17	179.9°	179.8°
C10	C11	C18	H11	0.1°	0.1°
C11	C12	C14	C15	0.4°	0.0°
C12	C11	C18	C17	1.2°	0.5°
C11	C12	C14	H8	179.6°	179.9°
C12	C11	C18	H11	178.8°	179.6°
C18	C11	C12	C14	0.7°	0.2°
C11	C18	C17	H11	180.0°	179.9°
C11	C18	C17	C15	1.3°	0.5°
C11	C18	C17	H10	178.7°	179.8°
C12	C14	C15	H8	180.0°	179.9°
C12	C14	C15	C17	0.5°	0.0°
C12	C14	C15	O16	179.7°	180.0°
C14	C15	C17	C18	0.9°	0.2°
C14	C15	C17	O16	179.1°	180.0°
C14	C15	O16	H9	180.0°	89.9°
C14	C15	C17	H10	179.1°	180.0°
C18	C17	C15	H10	180.0°	179.8°
C18	C17	C15	O16	179.9°	179.8°
C17	C15	C14	H8	179.5°	179.9°
C17	C15	O16	H9	0.8°	90.1°
C15	C17	C18	H11	178.7°	179.7°
O16	C15	C14	H8	0.3°	0.1°
O16	C15	C17	H10	0.1°	0.0°
H2	C03	C04	H3	0.9°	0.0°
H5	C09	H6	H7	120.0°	119.9°
H10	C17	C18	H11	1.3°	0.1°

Release date:	2016-05-04
Definition date:	2015-09-17
Last modified:	2016-04-29
Release status:	REL
Processing site:	RCSB
Derived from:	5DRJ