0O7

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C1	C2	sing	1.53Å	1.52Å
C4	C5	doub	1.38Å	1.39Å	Aromatic
C4	C3	sing	1.38Å	1.39Å	Aromatic
C2	C3	sing	1.51Å	1.52Å
C5	C6	sing	1.39Å	1.40Å	Aromatic
C3	C8	doub	1.38Å	1.40Å	Aromatic
C10	C11	doub	1.38Å	1.39Å	Aromatic
C10	C9	sing	1.40Å	1.40Å	Aromatic
C11	C12	sing	1.39Å	1.40Å	Aromatic
C6	C9	sing	1.48Å	1.51Å
C6	C7	doub	1.39Å	1.41Å	Aromatic
C8	C7	sing	1.38Å	1.40Å	Aromatic
C9	C25	doub	1.39Å	1.41Å	Aromatic
C14	N13	sing	1.47Å	1.47Å
C12	N13	sing	1.40Å	1.40Å
C12	C24	doub	1.40Å	1.42Å	Aromatic
N13	S15	sing	1.67Å	1.67Å
C25	C24	sing	1.39Å	1.40Å	Aromatic
C24	C23	sing	1.48Å	1.48Å
O16	S15	doub	1.42Å	1.43Å
S15	O17	doub	1.42Å	1.41Å
S15	C18	sing	1.77Å	1.75Å
C23	C18	sing	1.42Å	1.41Å	Aromatic
C23	N22	doub	1.30Å	1.31Å	Aromatic
C18	C19	doub	1.33Å	1.34Å	Aromatic
N22	N20	sing	1.41Å	1.40Å	Aromatic
C19	N20	sing	1.36Å	1.35Å	Aromatic
C1	H1	sing	1.09Å	1.10Å
C1	H2	sing	1.09Å	1.10Å
C1	H3	sing	1.09Å	1.10Å
C2	H4	sing	1.09Å	1.10Å
C2	H5	sing	1.09Å	1.10Å
C4	H6	sing	1.08Å	1.08Å
C5	H7	sing	1.08Å	1.08Å
C7	H8	sing	1.08Å	1.08Å
C8	H9	sing	1.08Å	1.08Å
C10	H10	sing	1.08Å	1.08Å
C11	H11	sing	1.08Å	1.08Å
C14	H12	sing	1.09Å	1.10Å
C14	H13	sing	1.09Å	1.10Å
C14	H14	sing	1.09Å	1.10Å
C19	H15	sing	1.08Å	1.08Å
N20	H16	sing	0.97Å	1.00Å
C25	H17	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C1	C2	C3	108.7°	109.5°
C2	C1	H1	109.5°	109.5°
C2	C1	H2	109.5°	109.4°
C2	C1	H3	109.5°	109.5°
C1	C2	H4	109.7°	109.5°
C1	C2	H5	109.7°	109.5°
C5	C4	C3	122.2°	120.1°
C4	C5	C6	119.1°	119.9°
C5	C4	H6	118.9°	120.0°
C4	C5	H7	120.5°	120.0°
C4	C3	C2	118.4°	119.8°
C4	C3	C8	120.1°	120.3°
C3	C4	H6	118.9°	120.0°
C2	C3	C8	121.4°	119.9°
C3	C2	H4	109.7°	109.5°
C3	C2	H5	109.6°	109.5°
C5	C6	C9	121.8°	120.1°
C5	C6	C7	118.6°	119.7°
C6	C5	H7	120.5°	120.1°
C3	C8	C7	117.9°	120.2°
C3	C8	H9	121.0°	119.9°
C11	C10	C9	122.8°	120.2°
C10	C11	C12	119.3°	120.8°
C11	C10	H10	118.6°	119.9°
C10	C11	H11	120.3°	119.6°
C10	C9	C6	120.3°	120.1°
C10	C9	C25	118.1°	119.8°
C9	C10	H10	118.6°	119.9°
C11	C12	N13	116.8°	117.5°
C11	C12	C24	118.8°	119.1°
C12	C11	H11	120.3°	119.6°
C9	C6	C7	119.5°	120.1°
C6	C9	C25	121.6°	120.1°
C6	C7	C8	122.2°	119.9°
C6	C7	H8	118.9°	120.0°
C8	C7	H8	118.9°	120.1°
C7	C8	H9	121.1°	119.9°
C9	C25	C24	119.8°	120.1°
C9	C25	H17	120.1°	120.0°
C14	N13	C12	121.1°	120.1°
C14	N13	S15	119.2°	120.1°
N13	C14	H12	109.5°	109.5°
N13	C14	H13	109.4°	109.5°
N13	C14	H14	109.5°	109.4°
N13	C12	C24	124.3°	123.4°
C12	N13	S15	119.7°	119.9°
C12	C24	C25	121.0°	120.0°
C12	C24	C23	120.5°	121.0°
N13	S15	O16	101.0°	107.0°
N13	S15	O17	110.4°	107.0°
N13	S15	C18	105.5°	103.3°
C25	C24	C23	118.4°	118.9°
C24	C25	H17	120.1°	119.9°
C24	C23	C18	122.6°	121.5°
C24	C23	N22	129.1°	131.1°
O16	S15	O17	119.3°	123.7°
O16	S15	C18	108.8°	107.1°
O17	S15	C18	110.7°	107.0°
S15	C18	C23	119.9°	119.8°
S15	C18	C19	130.9°	131.5°
C18	C23	N22	108.3°	107.4°
C23	C18	C19	109.2°	108.7°
C23	N22	N20	106.1°	108.2°
C18	C19	N20	105.6°	107.5°
C18	C19	H15	127.2°	126.2°
N22	N20	C19	110.9°	108.3°
N22	N20	H16	124.6°	125.9°
N20	C19	H15	127.2°	126.3°
C19	N20	H16	124.6°	125.8°
H1	C1	H2	109.5°	109.4°
H1	C1	H3	109.4°	109.5°
H2	C1	H3	109.5°	109.5°
H4	C2	H5	109.5°	109.4°
H12	C14	H13	109.5°	109.5°
H12	C14	H14	109.5°	109.5°
H13	C14	H14	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C1	C2	C3	C4	77.3°	89.8°
C1	C2	C3	H4	119.9°	120.0°
C1	C2	C3	H5	119.9°	120.0°
C1	C2	C3	C8	103.9°	90.0°
C2	C1	H1	H2	120.0°	119.9°
C2	C1	H1	H3	120.0°	120.1°
C2	C1	H2	H3	120.0°	120.0°
C1	C2	H4	H5	120.4°	120.0°
C5	C4	C3	H6	180.0°	180.0°
C5	C4	C3	C2	179.2°	180.0°
C4	C5	C6	H7	180.0°	180.0°
C5	C4	C3	C8	0.2°	0.2°
C4	C5	C6	C9	178.8°	180.0°
C4	C5	C6	C7	2.3°	0.1°
C4	C3	C2	C8	178.9°	179.8°
C3	C4	C5	C6	1.3°	0.0°
C4	C3	C8	C7	0.1°	0.5°
C4	C3	C2	H4	162.9°	150.2°
C4	C3	C2	H5	42.6°	30.3°
C3	C4	C5	H7	178.6°	180.0°
C4	C3	C8	H9	179.9°	179.8°
C2	C3	C8	C7	179.0°	179.7°
C3	C2	C1	H1	180.0°	59.9°
C3	C2	C1	H2	60.0°	60.0°
C3	C2	C1	H3	60.0°	180.0°
C3	C2	H4	H5	120.3°	120.0°
C2	C3	C4	H6	0.9°	0.0°
C2	C3	C8	H9	1.0°	0.0°
C5	C6	C9	C10	38.2°	0.3°
C5	C6	C9	C7	176.5°	179.9°
C5	C6	C7	C8	2.2°	0.3°
C5	C6	C9	C25	144.0°	180.0°
C6	C5	C4	H6	178.7°	180.0°
C5	C6	C7	H8	177.8°	180.0°
C3	C8	C7	C6	1.1°	0.6°
C3	C8	C7	H9	180.0°	179.7°
C8	C3	C2	H4	16.0°	30.0°
C8	C3	C2	H5	136.3°	150.0°
C8	C3	C4	H6	179.8°	179.7°
C3	C8	C7	H8	178.9°	179.7°
C11	C10	C9	H10	180.0°	180.0°
C10	C11	C12	H11	180.0°	180.0°
C11	C10	C9	C6	176.3°	179.7°
C11	C10	C9	C25	1.6°	0.6°
C10	C11	C12	N13	178.7°	179.0°
C10	C11	C12	C24	0.9°	0.2°
C9	C10	C11	C12	2.3°	0.3°
C10	C9	C6	C25	177.8°	179.7°
C10	C9	C6	C7	138.3°	179.8°
C10	C9	C25	C24	0.5°	0.5°
C9	C10	C11	H11	177.7°	179.7°
C10	C9	C25	H17	179.6°	179.9°
C11	C12	N13	C14	20.3°	30.0°
C11	C12	N13	C24	177.7°	179.1°
C11	C12	N13	S15	157.7°	150.0°
C11	C12	C24	C25	1.1°	0.3°
C11	C12	C24	C23	179.4°	178.8°
C12	C11	C10	H10	177.7°	179.7°
C9	C6	C7	C8	178.8°	179.8°
C6	C9	C25	C24	178.3°	179.9°
C9	C6	C5	H7	1.2°	0.1°
C9	C6	C7	H8	1.2°	0.1°
C6	C9	C10	H10	3.7°	0.3°
C6	C9	C25	H17	1.7°	0.2°
C6	C7	C8	H8	180.0°	179.7°
C7	C6	C9	C25	39.5°	0.1°
C7	C6	C5	H7	177.7°	180.0°
C6	C7	C8	H9	178.9°	179.7°
C9	C25	C24	C12	1.8°	0.0°
C9	C25	C24	H17	180.0°	179.7°
C9	C25	C24	C23	179.9°	179.2°
C25	C9	C10	H10	178.4°	179.4°
C14	N13	C12	S15	178.0°	180.0°
C14	N13	C12	C24	157.4°	149.1°
C14	N13	S15	O16	96.0°	29.9°
C14	N13	S15	O17	31.2°	104.5°
C14	N13	S15	C18	150.8°	142.7°
N13	C14	H12	H13	120.0°	120.1°
N13	C14	H12	H14	120.0°	119.9°
N13	C14	H13	H14	120.0°	120.0°
N13	C12	C24	C25	176.5°	178.8°
N13	C12	C24	C23	1.7°	2.0°
C12	N13	S15	O16	82.0°	150.1°
C12	N13	S15	O17	150.8°	75.5°
C12	N13	S15	C18	31.2°	37.3°
N13	C12	C11	H11	1.3°	1.0°
C12	N13	C14	H12	178.0°	90.0°
C12	N13	C14	H13	58.0°	150.0°
C12	N13	C14	H14	62.0°	30.0°
C24	C12	N13	S15	24.6°	30.9°
C12	C24	C25	C23	178.3°	179.2°
C12	C24	C23	C18	9.7°	13.9°
C12	C24	C23	N22	168.4°	166.3°
C24	C12	C11	H11	179.1°	179.8°
C12	C24	C25	H17	178.2°	179.7°
N13	S15	O16	O17	121.1°	124.8°
N13	S15	O16	C18	110.7°	110.3°
N13	S15	O17	C18	116.4°	110.2°
N13	S15	C18	C23	20.8°	22.2°
N13	S15	C18	C19	160.3°	157.8°
S15	N13	C14	H12	0.0°	90.0°
S15	N13	C14	H13	120.0°	30.0°
S15	N13	C14	H14	120.0°	150.0°
C25	C24	C23	C18	172.0°	165.3°
C25	C24	C23	N22	9.9°	14.5°
C24	C23	C18	S15	2.5°	0.4°
C24	C23	C18	N22	178.4°	179.8°
C24	C23	C18	C19	178.3°	179.7°
C24	C23	N22	N20	178.9°	179.6°
C23	C24	C25	H17	0.1°	1.1°
O16	S15	O17	C18	127.3°	125.0°
O16	S15	C18	C23	86.9°	134.9°
O16	S15	C18	C19	92.1°	45.0°
O17	S15	C18	C23	140.2°	90.6°
O17	S15	C18	C19	40.8°	89.5°
S15	C18	C23	C19	179.2°	179.9°
S15	C18	C23	N22	179.1°	179.8°
S15	C18	C19	N20	178.3°	179.8°
S15	C18	C19	H15	1.7°	0.2°
C18	C23	N22	N20	0.6°	0.2°
C23	C18	C19	N20	0.8°	0.1°
C23	C18	C19	H15	179.2°	179.9°
N22	C23	C18	C19	0.1°	0.2°
C23	N22	N20	C19	1.1°	0.1°
C23	N22	N20	H16	178.9°	179.9°
C18	C19	N20	N22	1.1°	0.0°
C18	C19	N20	H15	180.0°	180.0°
C18	C19	N20	H16	178.8°	180.0°
N22	N20	C19	H16	180.0°	180.0°
N22	N20	C19	H15	178.8°	180.0°
H1	C1	H2	H3	120.0°	120.0°
H1	C1	C2	H4	60.1°	60.1°
H1	C1	C2	H5	60.1°	180.0°
H2	C1	C2	H4	59.9°	180.0°
H2	C1	C2	H5	179.9°	60.1°
H3	C1	C2	H4	179.9°	60.0°
H3	C1	C2	H5	59.9°	59.9°
H6	C4	C5	H7	1.3°	0.0°
H8	C7	C8	H9	1.1°	0.0°
H10	C10	C11	H11	2.3°	0.3°
H12	C14	H13	H14	120.0°	120.0°
H15	C19	N20	H16	1.2°	0.0°

Definition date:	2012-03-29
Last modified:	2012-08-17
Release status:	REL
Processing site:	RCSB
Derived from:	4EBV