ZEG

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
O01	S02	doub	1.42Å	1.46Å
O27	S02	doub	1.42Å	1.47Å
C05	C04	sing	1.53Å	1.52Å
C05	O06	sing	1.43Å	1.40Å
S02	N03	sing	1.66Å	1.70Å
S02	C09	sing	1.76Å	1.80Å
N03	C04	sing	1.47Å	1.47Å
N03	C08	sing	1.47Å	1.46Å
C07	O06	sing	1.43Å	1.40Å
C07	C08	sing	1.53Å	1.53Å
C09	C10	doub	1.38Å	1.39Å	Aromatic
C09	C26	sing	1.38Å	1.38Å	Aromatic
C10	C11	sing	1.38Å	1.38Å	Aromatic
C26	C25	doub	1.38Å	1.38Å	Aromatic
C11	C12	doub	1.39Å	1.38Å	Aromatic
C25	C12	sing	1.39Å	1.38Å	Aromatic
C12	C13	sing	1.48Å	1.51Å
C13	N24	sing	1.32Å	1.45Å	Aromatic
C13	C14	doub	1.35Å	1.42Å	Aromatic
N24	C16	doub	1.30Å	1.37Å	Aromatic
C14	S15	sing	1.76Å	1.59Å	Aromatic
C16	S15	sing	1.76Å	1.63Å	Aromatic
C16	C17	sing	1.48Å	1.51Å
C18	C17	doub	1.39Å	1.39Å	Aromatic
C18	C19	sing	1.38Å	1.38Å	Aromatic
C17	C23	sing	1.40Å	1.38Å	Aromatic
C19	C20	doub	1.39Å	1.38Å	Aromatic
C23	C22	doub	1.38Å	1.38Å	Aromatic
C20	C22	sing	1.39Å	1.38Å	Aromatic
C20	F21	sing	1.35Å	1.35Å
C05	H1	sing	1.09Å	1.10Å
C05	H2	sing	1.09Å	1.10Å
C04	H3	sing	1.09Å	1.10Å
C04	H4	sing	1.09Å	1.10Å
C07	H5	sing	1.09Å	1.10Å
C07	H6	sing	1.09Å	1.10Å
C08	H7	sing	1.09Å	1.10Å
C08	H8	sing	1.09Å	1.10Å
C11	H9	sing	1.08Å	1.08Å
C10	H10	sing	1.08Å	1.08Å
C14	H11	sing	1.08Å	1.08Å
C18	H12	sing	1.08Å	1.08Å
C19	H13	sing	1.08Å	1.08Å
C22	H14	sing	1.08Å	1.08Å
C23	H15	sing	1.08Å	1.08Å
C25	H16	sing	1.08Å	1.08Å
C26	H17	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
O01	S02	O27	105.2°	123.2°
O01	S02	N03	110.8°	106.4°
O01	S02	C09	113.0°	106.4°
O27	S02	N03	111.4°	106.4°
O27	S02	C09	111.5°	106.4°
C04	C05	O06	112.5°	109.2°
C05	C04	N03	114.0°	108.4°
C04	C05	H1	108.7°	109.6°
C04	C05	H2	108.7°	109.5°
C05	C04	H3	108.3°	109.7°
C05	C04	H4	108.3°	109.7°
C05	O06	C07	116.8°	114.2°
O06	C05	H1	108.7°	109.5°
O06	C05	H2	108.7°	109.5°
N03	S02	C09	105.1°	107.2°
S02	N03	C04	119.7°	121.0°
S02	N03	C08	119.7°	121.0°
S02	C09	C10	120.1°	119.9°
S02	C09	C26	118.9°	119.8°
C04	N03	C08	107.5°	118.0°
N03	C04	H3	108.3°	109.7°
N03	C04	H4	108.3°	109.7°
N03	C08	C07	109.5°	108.4°
N03	C08	H7	109.5°	109.7°
N03	C08	H8	109.4°	109.7°
O06	C07	C08	114.9°	109.2°
O06	C07	H5	108.1°	109.5°
O06	C07	H6	108.1°	109.5°
C08	C07	H5	108.1°	109.5°
C08	C07	H6	108.1°	109.5°
C07	C08	H7	109.5°	109.7°
C07	C08	H8	109.5°	109.7°
C10	C09	C26	120.9°	120.3°
C09	C10	C11	120.2°	120.1°
C09	C10	H10	119.9°	119.9°
C09	C26	C25	119.0°	120.1°
C09	C26	H17	120.5°	120.0°
C10	C11	C12	118.5°	119.8°
C10	C11	H9	120.7°	120.1°
C11	C10	H10	119.9°	119.9°
C26	C25	C12	119.6°	119.9°
C26	C25	H16	120.2°	120.1°
C25	C26	H17	120.5°	119.9°
C11	C12	C25	121.8°	119.8°
C11	C12	C13	119.7°	120.1°
C12	C11	H9	120.7°	120.1°
C25	C12	C13	118.5°	120.1°
C12	C25	H16	120.2°	120.0°
C12	C13	N24	121.4°	122.3°
C12	C13	C14	127.1°	122.3°
N24	C13	C14	111.5°	115.4°
C13	N24	C16	110.1°	117.0°
C13	C14	S15	109.0°	108.2°
C13	C14	H11	125.5°	125.9°
N24	C16	S15	110.7°	109.4°
N24	C16	C17	120.8°	125.3°
C14	S15	C16	98.8°	90.0°
S15	C14	H11	125.5°	125.9°
S15	C16	C17	128.5°	125.3°
C16	C17	C18	118.0°	120.1°
C16	C17	C23	120.6°	120.1°
C17	C18	C19	119.9°	119.9°
C18	C17	C23	121.4°	119.8°
C17	C18	H12	120.0°	120.0°
C18	C19	C20	118.7°	120.1°
C19	C18	H12	120.0°	120.0°
C18	C19	H13	120.7°	119.9°
C17	C23	C22	118.4°	119.8°
C17	C23	H15	120.8°	120.1°
C19	C20	C22	121.6°	120.2°
C19	C20	F21	119.5°	119.9°
C20	C19	H13	120.7°	119.9°
C23	C22	C20	120.0°	120.2°
C23	C22	H14	120.0°	119.9°
C22	C23	H15	120.8°	120.1°
C22	C20	F21	119.0°	119.9°
C20	C22	H14	120.0°	119.9°
H1	C05	H2	109.5°	109.5°
H3	C04	H4	109.4°	109.7°
H5	C07	H6	109.5°	109.6°
H7	C08	H8	109.5°	109.6°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
O01	S02	O27	N03	120.1°	122.9°
O01	S02	O27	C09	122.8°	122.9°
O01	S02	N03	C09	122.4°	113.5°
O01	S02	N03	C04	61.9°	156.5°
O01	S02	N03	C08	161.8°	23.5°
O01	S02	C09	C10	64.2°	23.6°
O01	S02	C09	C26	117.9°	156.5°
O27	S02	N03	C09	120.9°	113.6°
O27	S02	N03	C04	178.6°	23.6°
O27	S02	N03	C08	45.1°	156.5°
O27	S02	C09	C10	177.6°	156.5°
O27	S02	C09	C26	0.4°	23.6°
C04	C05	O06	H1	120.4°	120.0°
C04	C05	O06	H2	120.5°	119.9°
C05	C04	N03	S02	161.3°	129.4°
C05	C04	N03	H3	120.7°	119.8°
C05	C04	N03	H4	120.7°	119.7°
C05	C04	N03	C08	57.6°	50.5°
C04	C05	O06	C07	41.3°	62.6°
C04	C05	H1	H2	118.6°	120.1°
C05	C04	H3	H4	117.9°	120.6°
O06	C05	C04	N03	48.5°	52.4°
C05	O06	C07	C08	45.3°	62.6°
O06	C05	H1	H2	118.6°	120.1°
O06	C05	C04	H3	72.2°	67.4°
O06	C05	C04	H4	169.2°	172.0°
C05	O06	C07	H5	75.5°	177.5°
C05	O06	C07	H6	166.1°	57.3°
S02	N03	C04	C08	141.0°	180.0°
S02	N03	C08	C07	161.0°	129.5°
N03	S02	C09	C10	56.8°	90.0°
N03	S02	C09	C26	121.2°	90.0°
S02	N03	C04	H3	78.0°	110.8°
S02	N03	C04	H4	40.7°	9.7°
S02	N03	C08	H7	79.0°	9.7°
S02	N03	C08	H8	41.0°	110.7°
C09	S02	N03	C04	60.5°	90.0°
C09	S02	N03	C08	75.8°	90.0°
S02	C09	C10	C26	177.9°	179.9°
S02	C09	C10	C11	178.5°	180.0°
S02	C09	C26	C25	178.5°	179.7°
S02	C09	C10	H10	1.5°	0.1°
S02	C09	C26	H17	1.5°	0.0°
C04	N03	C08	C07	58.0°	50.5°
N03	C04	C05	H1	71.9°	67.6°
N03	C04	C05	H2	169.0°	172.3°
N03	C04	H3	H4	117.9°	120.5°
C04	N03	C08	H7	62.0°	170.3°
C04	N03	C08	H8	178.0°	69.3°
N03	C08	C07	O06	53.7°	52.3°
N03	C08	C07	H7	120.0°	119.8°
N03	C08	C07	H8	120.0°	119.8°
C08	N03	C04	H3	63.1°	69.3°
C08	N03	C04	H4	178.3°	170.2°
N03	C08	C07	H5	67.1°	172.2°
N03	C08	C07	H6	174.5°	67.6°
N03	C08	H7	H8	120.0°	120.5°
O06	C07	C08	H5	120.8°	119.9°
O06	C07	C08	H6	120.8°	119.9°
C07	O06	C05	H1	79.1°	57.4°
C07	O06	C05	H2	161.8°	177.5°
O06	C07	H5	H6	117.6°	120.1°
O06	C07	C08	H7	66.3°	172.0°
O06	C07	C08	H8	173.7°	67.5°
C08	C07	H5	H6	117.5°	120.2°
C07	C08	H7	H8	120.0°	120.5°
C09	C10	C11	H10	180.0°	180.0°
C10	C09	C26	C25	0.6°	0.3°
C09	C10	C11	C12	0.9°	0.0°
C09	C10	C11	H9	179.1°	179.9°
C10	C09	C26	H17	179.4°	180.0°
C26	C09	C10	C11	0.6°	0.0°
C09	C26	C25	H17	180.0°	179.7°
C09	C26	C25	C12	0.9°	0.5°
C26	C09	C10	H10	179.5°	180.0°
C09	C26	C25	H16	179.1°	179.7°
C10	C11	C12	H9	180.0°	179.9°
C10	C11	C12	C25	1.3°	0.2°
C10	C11	C12	C13	179.1°	180.0°
C26	C25	C12	C11	1.3°	0.5°
C26	C25	C12	H16	180.0°	179.8°
C26	C25	C12	C13	179.1°	179.7°
C11	C12	C25	C13	177.8°	179.7°
C11	C12	C13	N24	153.0°	0.0°
C11	C12	C13	C14	26.5°	179.6°
C12	C11	C10	H10	179.1°	180.0°
C11	C12	C25	H16	178.7°	179.7°
C25	C12	C13	N24	24.8°	179.7°
C25	C12	C13	C14	155.6°	0.2°
C25	C12	C11	H9	178.7°	179.8°
C12	C25	C26	H17	179.1°	179.8°
C12	C13	N24	C14	179.6°	179.6°
C12	C13	N24	C16	178.8°	180.0°
C12	C13	C14	S15	179.2°	179.8°
C13	C12	C11	H9	0.9°	0.1°
C12	C13	C14	H11	0.8°	0.5°
C13	C12	C25	H16	0.9°	0.0°
N24	C13	C14	S15	0.4°	0.6°
C13	N24	C16	S15	1.0°	0.0°
C13	N24	C16	C17	179.8°	179.7°
N24	C13	C14	H11	179.6°	179.9°
C14	C13	N24	C16	0.9°	0.4°
C13	C14	S15	H11	180.0°	179.4°
C13	C14	S15	C16	0.1°	0.5°
N24	C16	S15	C14	0.7°	0.3°
N24	C16	S15	C17	178.7°	179.7°
N24	C16	C17	C18	13.2°	0.0°
N24	C16	C17	C23	167.0°	179.7°
C14	S15	C16	C17	179.4°	180.0°
S15	C16	C17	C18	165.4°	179.7°
S15	C16	C17	C23	14.4°	0.0°
C16	S15	C14	H11	179.9°	179.8°
C16	C17	C18	C23	179.7°	179.7°
C16	C17	C18	C19	179.6°	180.0°
C16	C17	C23	C22	179.4°	179.8°
C16	C17	C18	H12	0.4°	0.0°
C16	C17	C23	H15	0.6°	0.0°
C17	C18	C19	H12	180.0°	180.0°
C17	C18	C19	C20	0.4°	0.0°
C18	C17	C23	C22	0.4°	0.5°
C17	C18	C19	H13	179.6°	180.0°
C18	C17	C23	H15	179.7°	179.7°
C19	C18	C17	C23	0.1°	0.3°
C18	C19	C20	H13	180.0°	180.0°
C18	C19	C20	C22	0.7°	0.0°
C18	C19	C20	F21	179.7°	179.9°
C17	C23	C22	H15	180.0°	179.8°
C17	C23	C22	C20	0.0°	0.4°
C23	C17	C18	H12	179.9°	179.8°
C17	C23	C22	H14	179.9°	179.7°
C19	C20	C22	C23	0.5°	0.2°
C19	C20	C22	F21	179.6°	179.9°
C20	C19	C18	H12	179.6°	180.0°
C19	C20	C22	H14	179.5°	180.0°
C23	C22	C20	H14	180.0°	179.8°
C23	C22	C20	F21	179.9°	179.7°
C22	C20	C19	H13	179.3°	180.0°
C20	C22	C23	H15	180.0°	179.8°
F21	C20	C19	H13	0.3°	0.1°
F21	C20	C22	H14	0.1°	0.1°
H1	C05	C04	H3	167.4°	172.7°
H1	C05	C04	H4	48.8°	52.1°
H2	C05	C04	H3	48.3°	52.5°
H2	C05	C04	H4	70.3°	68.1°
H5	C07	C08	H7	172.9°	68.1°
H5	C07	C08	H8	52.9°	52.4°
H6	C07	C08	H7	54.5°	52.2°
H6	C07	C08	H8	65.5°	172.6°
H9	C11	C10	H10	0.9°	0.1°
H12	C18	C19	H13	0.4°	0.0°
H14	C22	C23	H15	0.0°	0.1°
H16	C25	C26	H17	0.9°	0.0°

Release date:	2022-04-20
Definition date:	2021-04-15
Last modified:	2022-04-15
Release status:	REL
Processing site:	RCSB
Derived from:	7MHE