6DK

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
C12	C13	doub	0.00Å	1.40Å	Aromatic
C12	C11	sing	0.00Å	1.41Å	Aromatic
C13	C14	sing	0.00Å	1.41Å	Aromatic
C11	C10	doub	0.00Å	1.40Å	Aromatic
C14	C9	doub	0.00Å	1.40Å	Aromatic
C10	C9	sing	0.00Å	1.41Å	Aromatic
C9	N	sing	0.00Å	1.39Å
N	C8	sing	0.00Å	1.36Å
C8	O	doub	0.00Å	1.22Å
C8	C7	sing	0.00Å	1.53Å
C7	C6	sing	0.00Å	1.54Å
C6	C5	sing	0.00Å	1.53Å
C5	C4	sing	0.00Å	1.53Å
C4	C3	sing	0.00Å	1.53Å
C3	C2	sing	0.00Å	1.53Å
C2	C1	sing	0.00Å	1.54Å
O1	C1	sing	0.00Å	1.41Å
C1	O2	sing	0.00Å	1.42Å
C1	C	sing	0.00Å	1.54Å
F	C	sing	0.00Å	1.31Å
C	F2	sing	0.00Å	1.31Å
C	F1	sing	0.00Å	1.32Å
N	H1	sing	0.00Å	1.00Å
O1	H2	sing	0.00Å	0.95Å
C2	H3	sing	0.00Å	1.10Å
C2	H4	sing	0.00Å	1.10Å
O2	H5	sing	0.00Å	0.95Å
C3	H6	sing	0.00Å	1.10Å
C3	H7	sing	0.00Å	1.10Å
C4	H8	sing	0.00Å	1.10Å
C4	H9	sing	0.00Å	1.10Å
C5	H10	sing	0.00Å	1.10Å
C5	H11	sing	0.00Å	1.10Å
C6	H12	sing	0.00Å	1.10Å
C6	H13	sing	0.00Å	1.10Å
C7	H14	sing	0.00Å	1.10Å
C7	H15	sing	0.00Å	1.10Å
C10	H16	sing	0.00Å	1.08Å
C11	H17	sing	0.00Å	1.08Å
C12	H18	sing	0.00Å	1.08Å
C13	H19	sing	0.00Å	1.08Å
C14	H20	sing	0.00Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
C13	C12	C11	118.6°	90.0°
C12	C13	C14	119.8°	90.0°
C13	C12	H18	120.7°	90.0°
C12	C13	H19	120.1°	90.0°
C12	C11	C10	120.5°	90.0°
C12	C11	H17	119.8°	90.0°
C11	C12	H18	120.7°	90.0°
C13	C14	C9	122.7°	90.0°
C14	C13	H19	120.1°	90.0°
C13	C14	H20	118.6°	90.0°
C11	C10	C9	121.6°	90.0°
C11	C10	H16	119.2°	90.0°
C10	C11	H17	119.7°	90.0°
C14	C9	C10	116.8°	90.0°
C14	C9	N	116.7°	90.0°
C9	C14	H20	118.7°	90.0°
C10	C9	N	126.0°	90.0°
C9	C10	H16	119.2°	90.0°
C9	N	C8	124.4°	90.0°
C9	N	H1	117.8°	90.0°
N	C8	O	125.2°	90.0°
N	C8	C7	117.8°	90.0°
C8	N	H1	117.8°	90.0°
O	C8	C7	117.0°	90.0°
C8	C7	C6	110.9°	90.0°
C8	C7	H14	109.1°	90.0°
C8	C7	H15	109.1°	90.0°
C7	C6	C5	111.1°	90.0°
C7	C6	H12	109.1°	90.0°
C7	C6	H13	109.1°	90.0°
C6	C7	H14	109.1°	90.0°
C6	C7	H15	109.1°	90.0°
C6	C5	C4	110.1°	90.0°
C6	C5	H10	109.3°	90.0°
C6	C5	H11	109.3°	90.0°
C5	C6	H12	109.1°	90.0°
C5	C6	H13	109.1°	90.0°
C5	C4	C3	112.5°	90.0°
C5	C4	H8	108.7°	90.0°
C5	C4	H9	108.7°	90.0°
C4	C5	H10	109.3°	90.0°
C4	C5	H11	109.3°	90.0°
C4	C3	C2	108.9°	90.0°
C4	C3	H6	109.6°	90.0°
C4	C3	H7	109.6°	90.0°
C3	C4	H8	108.7°	90.0°
C3	C4	H9	108.7°	90.0°
C3	C2	C1	116.8°	90.0°
C3	C2	H3	107.6°	90.0°
C3	C2	H4	107.6°	90.0°
C2	C3	H6	109.6°	90.0°
C2	C3	H7	109.6°	90.0°
C2	C1	O1	110.6°	90.0°
C2	C1	O2	115.3°	90.0°
C2	C1	C	110.0°	90.0°
C1	C2	H3	107.6°	90.0°
C1	C2	H4	107.6°	90.0°
O1	C1	O2	94.8°	90.0°
O1	C1	C	111.6°	90.0°
C1	O1	H2	109.5°	90.0°
O2	C1	C	113.8°	90.0°
C1	O2	H5	109.5°	90.0°
C1	C	F	110.0°	90.0°
C1	C	F2	111.2°	90.0°
C1	C	F1	110.3°	90.0°
F	C	F2	107.5°	90.0°
F	C	F1	108.7°	90.0°
F2	C	F1	108.9°	90.0°
H3	C2	H4	109.5°	90.0°
H6	C3	H7	109.5°	90.0°
H8	C4	H9	109.5°	90.0°
H10	C5	H11	109.5°	90.0°
H12	C6	H13	109.4°	90.0°
H14	C7	H15	109.5°	90.0°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
C13	C12	C11	H18	180.0°	90.0°
C12	C13	C14	H19	180.0°	90.0°
C13	C12	C11	C10	0.8°	90.0°
C12	C13	C14	C9	0.4°	90.0°
C13	C12	C11	H17	179.2°	90.0°
C12	C13	C14	H20	179.6°	90.0°
C11	C12	C13	C14	0.7°	90.0°
C12	C11	C10	H17	180.0°	90.0°
C12	C11	C10	C9	0.3°	90.0°
C12	C11	C10	H16	179.7°	90.0°
C11	C12	C13	H19	179.3°	90.0°
C13	C14	C9	H20	180.0°	90.0°
C13	C14	C9	C10	1.4°	90.0°
C13	C14	C9	N	173.8°	90.0°
C14	C13	C12	H18	179.3°	90.0°
C11	C10	C9	C14	1.4°	90.0°
C11	C10	C9	H16	180.0°	90.0°
C11	C10	C9	N	172.9°	90.0°
C10	C11	C12	H18	179.2°	90.0°
C14	C9	C10	N	171.6°	90.0°
C14	C9	N	C8	140.2°	90.0°
C14	C9	N	H1	39.8°	90.0°
C14	C9	C10	H16	178.6°	90.0°
C9	C14	C13	H19	179.6°	90.0°
C10	C9	N	C8	31.3°	90.0°
C10	C9	N	H1	148.6°	90.0°
C9	C10	C11	H17	179.7°	90.0°
C10	C9	C14	H20	178.6°	90.0°
C9	N	C8	H1	180.0°	90.0°
C9	N	C8	O	5.7°	90.0°
C9	N	C8	C7	174.4°	90.0°
N	C9	C10	H16	7.1°	90.0°
N	C9	C14	H20	6.2°	90.0°
N	C8	O	C7	179.9°	90.0°
N	C8	C7	C6	171.0°	90.0°
N	C8	C7	H14	50.8°	90.0°
N	C8	C7	H15	68.8°	90.0°
O	C8	C7	C6	8.8°	90.0°
O	C8	N	H1	174.2°	90.0°
O	C8	C7	H14	129.1°	90.0°
O	C8	C7	H15	111.4°	90.0°
C8	C7	C6	H14	120.2°	90.0°
C8	C7	C6	H15	120.2°	90.0°
C8	C7	C6	C5	167.4°	90.0°
C7	C8	N	H1	5.6°	90.0°
C8	C7	C6	H12	72.3°	90.0°
C8	C7	C6	H13	47.2°	90.0°
C8	C7	H14	H15	119.3°	90.0°
C7	C6	C5	H12	120.3°	90.0°
C7	C6	C5	H13	120.3°	90.0°
C7	C6	C5	C4	174.7°	90.0°
C7	C6	C5	H10	65.3°	90.0°
C7	C6	C5	H11	54.6°	90.0°
C7	C6	H12	H13	119.3°	90.0°
C6	C7	H14	H15	119.3°	90.0°
C6	C5	C4	H10	120.1°	90.0°
C6	C5	C4	H11	120.1°	90.0°
C6	C5	C4	C3	173.9°	90.0°
C6	C5	C4	H8	65.7°	90.0°
C6	C5	C4	H9	53.5°	90.0°
C6	C5	H10	H11	119.7°	90.0°
C5	C6	H12	H13	119.2°	90.0°
C5	C6	C7	H14	47.2°	90.0°
C5	C6	C7	H15	72.4°	90.0°
C5	C4	C3	H8	120.4°	90.0°
C5	C4	C3	H9	120.4°	90.0°
C5	C4	C3	C2	166.3°	90.0°
C5	C4	C3	H6	46.5°	90.0°
C5	C4	C3	H7	73.7°	90.0°
C5	C4	H8	H9	118.6°	90.0°
C4	C5	H10	H11	119.7°	90.0°
C4	C5	C6	H12	54.4°	90.0°
C4	C5	C6	H13	65.1°	90.0°
C4	C3	C2	H6	119.9°	90.0°
C4	C3	C2	H7	119.9°	90.0°
C4	C3	C2	C1	170.6°	90.0°
C4	C3	C2	H3	49.6°	90.0°
C4	C3	C2	H4	68.3°	90.0°
C4	C3	H6	H7	120.3°	90.0°
C3	C4	H8	H9	118.6°	90.0°
C3	C4	C5	H10	53.8°	90.0°
C3	C4	C5	H11	66.0°	90.0°
C3	C2	C1	H3	121.1°	90.0°
C3	C2	C1	H4	121.1°	90.0°
C3	C2	C1	O1	55.8°	90.0°
C3	C2	C1	O2	50.2°	90.0°
C3	C2	C1	C	179.5°	90.0°
C3	C2	H3	H4	116.7°	90.0°
C2	C3	H6	H7	120.2°	90.0°
C2	C3	C4	H8	73.2°	90.0°
C2	C3	C4	H9	45.9°	90.0°
C2	C1	O1	O2	119.3°	90.0°
C2	C1	O1	C	122.8°	90.0°
C2	C1	O2	C	128.5°	90.0°
C2	C1	C	F	59.0°	90.0°
C2	C1	C	F2	60.0°	90.0°
C2	C1	C	F1	179.0°	90.0°
C2	C1	O1	H2	180.0°	90.0°
C1	C2	H3	H4	116.6°	90.0°
C2	C1	O2	H5	180.0°	90.0°
C1	C2	C3	H6	69.5°	90.0°
C1	C2	C3	H7	50.7°	90.0°
O1	C1	O2	C	116.1°	90.0°
O1	C1	C	F	64.1°	90.0°
O1	C1	C	F2	176.9°	90.0°
O1	C1	C	F1	55.9°	90.0°
O1	C1	C2	H3	176.9°	90.0°
O1	C1	C2	H4	65.2°	90.0°
O1	C1	O2	H5	64.6°	90.0°
O2	C1	C	F	169.9°	90.0°
O2	C1	C	F2	71.1°	90.0°
O2	C1	C	F1	49.9°	90.0°
O2	C1	O1	H2	60.7°	90.0°
O2	C1	C2	H3	70.9°	90.0°
O2	C1	C2	H4	171.2°	90.0°
C1	C	F	F2	121.3°	90.0°
C1	C	F	F1	120.9°	90.0°
C1	C	F2	F1	121.8°	90.0°
C	C1	O1	H2	57.2°	90.0°
C	C1	C2	H3	59.4°	90.0°
C	C1	C2	H4	58.5°	90.0°
C	C1	O2	H5	51.6°	90.0°
F	C	F2	F1	117.7°	90.0°
H3	C2	C3	H6	169.5°	90.0°
H3	C2	C3	H7	70.4°	90.0°
H4	C2	C3	H6	51.6°	90.0°
H4	C2	C3	H7	171.8°	90.0°
H6	C3	C4	H8	166.9°	90.0°
H6	C3	C4	H9	74.0°	90.0°
H7	C3	C4	H8	46.7°	90.0°
H7	C3	C4	H9	165.9°	90.0°
H8	C4	C5	H10	174.2°	90.0°
H8	C4	C5	H11	54.4°	90.0°
H9	C4	C5	H10	66.6°	90.0°
H9	C4	C5	H11	173.6°	90.0°
H10	C5	C6	H12	174.5°	90.0°
H10	C5	C6	H13	55.0°	90.0°
H11	C5	C6	H12	65.7°	90.0°
H11	C5	C6	H13	174.8°	90.0°
H12	C6	C7	H14	167.4°	90.0°
H12	C6	C7	H15	47.9°	90.0°
H13	C6	C7	H14	73.0°	90.0°
H13	C6	C7	H15	167.4°	90.0°
H16	C10	C11	H17	0.3°	90.0°
H17	C11	C12	H18	0.8°	90.0°
H18	C12	C13	H19	0.7°	90.0°
H19	C13	C14	H20	0.4°	90.0°

Release date:	2016-11-30
Definition date:	2016-03-24
Last modified:	2016-11-25
Release status:	REL
Processing site:	RCSB
Derived from:	5G10