N6F

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
N1	C5	doub	1.32Å	1.34Å	Aromatic
N1	C4	sing	1.32Å	1.34Å	Aromatic
C5	C6	sing	1.38Å	1.38Å	Aromatic
C4	C3	doub	1.38Å	1.39Å	Aromatic
C6	C7	doub	1.39Å	1.39Å	Aromatic
C3	C7	sing	1.40Å	1.40Å	Aromatic
C3	N	sing	1.40Å	1.41Å
C7	N2	sing	1.40Å	1.41Å
N	C2	sing	1.35Å	1.36Å
CL	C14	sing	1.74Å	1.74Å
O	C2	doub	1.21Å	1.23Å
O1	C8	doub	1.21Å	1.23Å
C2	C1	sing	1.51Å	1.54Å
N2	C8	sing	1.35Å	1.36Å
C8	C9	sing	1.51Å	1.50Å
C15	C14	doub	1.38Å	1.38Å	Aromatic
C15	C10	sing	1.38Å	1.39Å	Aromatic
C14	C13	sing	1.38Å	1.38Å	Aromatic
C1	C10	sing	1.51Å	1.52Å
C1	C	sing	1.53Å	1.54Å
C10	C11	doub	1.38Å	1.39Å	Aromatic
C13	C12	doub	1.38Å	1.39Å	Aromatic
C11	C12	sing	1.38Å	1.39Å	Aromatic
C4	H1	sing	1.08Å	1.08Å
C5	H2	sing	1.08Å	1.08Å
C6	H3	sing	1.08Å	1.08Å
C13	H4	sing	1.08Å	1.08Å
C15	H5	sing	1.08Å	1.08Å
C12	H6	sing	1.08Å	1.08Å
C11	H7	sing	1.08Å	1.08Å
C1	H8	sing	1.09Å	1.10Å
C	H9	sing	1.09Å	1.10Å
C	H10	sing	1.09Å	1.10Å
C	H11	sing	1.09Å	1.10Å
N	H12	sing	0.97Å	1.00Å
N2	H13	sing	0.97Å	1.00Å
C9	H14	sing	1.09Å	1.10Å
C9	H15	sing	1.09Å	1.10Å
C9	H16	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C5	N1	C4	117.6°	122.0°
N1	C5	C6	124.2°	121.0°
N1	C5	H2	117.9°	119.5°
N1	C4	C3	123.1°	120.7°
N1	C4	H1	118.4°	119.6°
C5	C6	C7	117.8°	119.1°
C6	C5	H2	117.9°	119.5°
C5	C6	H3	121.1°	120.5°
C4	C3	C7	118.2°	119.0°
C4	C3	N	121.9°	120.5°
C3	C4	H1	118.4°	119.7°
C6	C7	C3	119.0°	118.2°
C6	C7	N2	122.2°	120.9°
C7	C6	H3	121.1°	120.4°
C7	C3	N	119.7°	120.5°
C3	C7	N2	118.8°	120.9°
C3	N	C2	124.6°	120.0°
C3	N	H12	117.7°	120.0°
C7	N2	C8	129.4°	120.0°
C7	N2	H13	115.3°	120.0°
N	C2	O	122.4°	120.0°
N	C2	C1	116.1°	120.0°
C2	N	H12	117.7°	120.0°
CL	C14	C15	119.0°	120.0°
CL	C14	C13	119.2°	120.0°
O	C2	C1	121.3°	120.0°
O1	C8	N2	123.2°	120.0°
O1	C8	C9	121.9°	120.0°
C2	C1	C10	109.2°	109.5°
C2	C1	C	123.6°	109.5°
C2	C1	H8	103.7°	109.5°
N2	C8	C9	114.8°	120.0°
C8	N2	H13	115.3°	120.0°
C8	C9	H14	109.5°	109.4°
C8	C9	H15	109.4°	109.5°
C8	C9	H16	109.4°	109.5°
C14	C15	C10	119.6°	120.0°
C15	C14	C13	121.8°	120.0°
C14	C15	H5	120.2°	120.0°
C15	C10	C1	120.2°	120.0°
C15	C10	C11	119.0°	120.0°
C10	C15	H5	120.2°	120.0°
C14	C13	C12	118.6°	120.0°
C14	C13	H4	120.7°	120.1°
C10	C1	C	110.5°	109.5°
C1	C10	C11	120.9°	120.0°
C10	C1	H8	103.9°	109.5°
C	C1	H8	103.7°	109.5°
C1	C	H9	109.5°	109.5°
C1	C	H10	109.5°	109.5°
C1	C	H11	109.5°	109.5°
C10	C11	C12	120.8°	120.0°
C10	C11	H7	119.6°	119.9°
C13	C12	C11	120.3°	120.0°
C12	C13	H4	120.7°	120.0°
C13	C12	H6	119.9°	120.0°
C11	C12	H6	119.8°	120.0°
C12	C11	H7	119.6°	120.0°
H9	C	H10	109.5°	109.5°
H9	C	H11	109.5°	109.5°
H10	C	H11	109.4°	109.4°
H14	C9	H15	109.5°	109.4°
H14	C9	H16	109.5°	109.5°
H15	C9	H16	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
N1	C5	C6	H2	180.0°	180.0°
C5	N1	C4	C3	0.9°	0.1°
N1	C5	C6	C7	0.4°	0.0°
C5	N1	C4	H1	179.1°	180.0°
N1	C5	C6	H3	179.6°	179.9°
C4	N1	C5	C6	0.2°	0.0°
N1	C4	C3	H1	180.0°	179.9°
N1	C4	C3	C7	1.1°	0.0°
N1	C4	C3	N	173.5°	180.0°
C4	N1	C5	H2	179.8°	180.0°
C5	C6	C7	H3	180.0°	179.9°
C5	C6	C7	C3	0.2°	0.1°
C5	C6	C7	N2	178.2°	180.0°
C4	C3	C7	C6	0.5°	0.0°
C4	C3	C7	N	174.7°	179.9°
C4	C3	C7	N2	178.9°	180.0°
C4	C3	N	C2	77.9°	24.7°
C4	C3	N	H12	102.1°	155.2°
C6	C7	C3	N2	178.5°	180.0°
C6	C7	C3	N	174.2°	179.9°
C6	C7	N2	C8	10.9°	24.6°
C7	C6	C5	H2	179.6°	180.0°
C6	C7	N2	H13	169.0°	155.5°
C7	C3	N	C2	96.5°	155.3°
C3	C7	N2	C8	170.6°	155.4°
C7	C3	C4	H1	178.9°	180.0°
C3	C7	C6	H3	179.8°	179.9°
C7	C3	N	H12	83.5°	24.7°
C3	C7	N2	H13	9.4°	24.5°
N	C3	C7	N2	4.2°	0.0°
C3	N	C2	H12	180.0°	180.0°
C3	N	C2	O	6.7°	5.6°
C3	N	C2	C1	169.1°	174.4°
N	C3	C4	H1	6.5°	0.1°
C7	N2	C8	O1	0.1°	5.6°
C7	N2	C8	H13	180.0°	179.9°
C7	N2	C8	C9	179.3°	174.5°
N2	C7	C6	H3	1.8°	0.1°
N	C2	O	C1	175.5°	180.0°
N	C2	C1	C10	146.6°	180.0°
N	C2	C1	C	14.0°	60.0°
N	C2	C1	H8	103.1°	60.0°
CL	C14	C15	C13	178.1°	180.0°
CL	C14	C15	C10	177.2°	180.0°
CL	C14	C13	C12	176.5°	179.9°
CL	C14	C13	H4	3.5°	0.0°
CL	C14	C15	H5	2.8°	0.0°
O	C2	C1	C10	37.6°	0.0°
O	C2	C1	C	170.2°	120.0°
O	C2	C1	H8	72.7°	120.0°
O	C2	N	H12	173.3°	174.4°
O1	C8	N2	C9	179.3°	179.9°
O1	C8	N2	H13	179.9°	174.4°
O1	C8	C9	H14	0.0°	180.0°
O1	C8	C9	H15	120.0°	60.1°
O1	C8	C9	H16	120.0°	60.0°
C2	C1	C10	C15	68.5°	59.7°
C2	C1	C10	C	139.1°	120.0°
C2	C1	C10	H8	110.2°	120.0°
C2	C1	C	H8	117.1°	120.0°
C2	C1	C10	C11	110.9°	120.0°
C2	C1	C	H9	180.0°	180.0°
C2	C1	C	H10	60.0°	60.0°
C2	C1	C	H11	60.0°	60.0°
C1	C2	N	H12	10.9°	5.6°
N2	C8	C9	H14	179.3°	0.1°
N2	C8	C9	H15	59.3°	120.0°
N2	C8	C9	H16	60.7°	120.0°
C9	C8	N2	H13	0.7°	5.6°
C8	C9	H14	H15	120.0°	119.9°
C8	C9	H14	H16	120.0°	120.1°
C8	C9	H15	H16	120.0°	120.1°
C14	C15	C10	H5	180.0°	180.0°
C14	C15	C10	C1	178.7°	179.7°
C14	C15	C10	C11	0.7°	0.0°
C15	C14	C13	C12	1.6°	0.1°
C15	C14	C13	H4	178.3°	180.0°
C10	C15	C14	C13	0.9°	0.0°
C15	C10	C1	C11	179.4°	179.7°
C15	C10	C1	C	70.6°	60.3°
C15	C10	C11	C12	1.6°	0.0°
C15	C10	C11	H7	178.4°	179.9°
C15	C10	C1	H8	178.7°	179.7°
C14	C13	C12	H4	180.0°	180.0°
C14	C13	C12	C11	0.8°	0.0°
C13	C14	C15	H5	179.1°	180.0°
C14	C13	C12	H6	179.2°	179.9°
C10	C1	C	H8	110.8°	120.0°
C1	C10	C11	C12	177.9°	179.7°
C1	C10	C15	H5	1.2°	0.3°
C1	C10	C11	H7	2.1°	0.4°
C10	C1	C	H9	47.9°	60.0°
C10	C1	C	H10	167.9°	180.0°
C10	C1	C	H11	72.1°	60.0°
C	C1	C10	C11	110.0°	120.0°
C1	C	H9	H10	120.0°	120.0°
C1	C	H9	H11	120.0°	120.0°
C1	C	H10	H11	120.0°	120.0°
C10	C11	C12	C13	0.8°	0.0°
C10	C11	C12	H7	180.0°	179.9°
C11	C10	C15	H5	179.3°	180.0°
C10	C11	C12	H6	179.2°	180.0°
C11	C10	C1	H8	0.7°	0.0°
C13	C12	C11	H6	180.0°	180.0°
C13	C12	C11	H7	179.2°	179.9°
C11	C12	C13	H4	179.2°	180.0°
H2	C5	C6	H3	0.4°	0.1°
H4	C13	C12	H6	0.8°	0.0°
H6	C12	C11	H7	0.8°	0.1°
H8	C1	C	H9	62.9°	60.0°
H8	C1	C	H10	57.1°	60.0°
H8	C1	C	H11	177.1°	180.0°
H9	C	H10	H11	120.0°	120.0°
H14	C9	H15	H16	120.0°	120.0°

Release date:	2023-11-08
Definition date:	2023-08-16
Last modified:	2023-11-03
Release status:	REL
Processing site:	RCSB
Derived from:	7GEA