D8F

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
OAD	NAE	doub	1.22Å	1.42Å
OAC	NAE	sing	1.22Å	1.41Å
NAE	CAO	sing	1.48Å	1.45Å
CAO	CAQ	doub	1.38Å	1.38Å	Aromatic
CAO	CAP	sing	1.38Å	1.38Å	Aromatic
CAQ	CAN	sing	1.38Å	1.40Å	Aromatic
CAP	CAM	doub	1.38Å	1.40Å	Aromatic
CAN	CAL	doub	1.39Å	1.36Å	Aromatic
CAM	CAL	sing	1.39Å	1.39Å	Aromatic
CAL	OAA	sing	1.36Å	1.41Å
OAA	CAK	sing	1.34Å	1.42Å
CAK	OAB	doub	1.21Å	1.18Å
CAK	CAI	sing	1.51Å	1.54Å
CAI	CAG	sing	1.53Å	1.54Å
CAG	CAF	sing	1.53Å	1.54Å
CAF	CAH	sing	1.53Å	1.53Å
CAH	CAJ	sing	1.53Å	1.53Å
CAF	HAF1	sing	1.09Å	1.10Å
CAF	HAF2	sing	1.09Å	1.10Å
CAG	HAG2	sing	1.09Å	1.10Å
CAG	HAG1	sing	1.09Å	1.10Å
CAH	HAH1	sing	1.09Å	1.10Å
CAH	HAH2	sing	1.09Å	1.10Å
CAI	HAI1	sing	1.09Å	1.10Å
CAI	HAI2	sing	1.09Å	1.10Å
CAJ	HAJ2	sing	1.09Å	1.10Å
CAJ	HAJ3	sing	1.09Å	1.10Å
CAJ	HAJ1	sing	1.09Å	1.10Å
CAM	HAM1	sing	1.08Å	1.08Å
CAN	HAN1	sing	1.08Å	1.08Å
CAP	HAP1	sing	1.08Å	1.08Å
CAQ	HAQ1	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
OAD	NAE	OAC	122.1°	120.0°
OAD	NAE	CAO	122.0°	120.0°
OAC	NAE	CAO	115.9°	120.0°
NAE	CAO	CAQ	122.6°	120.0°
NAE	CAO	CAP	119.6°	119.9°
CAQ	CAO	CAP	117.8°	120.1°
CAO	CAQ	CAN	121.7°	120.0°
CAO	CAQ	HAQ1	119.2°	120.0°
CAO	CAP	CAM	119.7°	120.1°
CAO	CAP	HAP1	120.2°	120.0°
CAQ	CAN	CAL	121.2°	119.9°
CAQ	CAN	HAN1	119.4°	120.0°
CAN	CAQ	HAQ1	119.1°	120.0°
CAP	CAM	CAL	122.6°	119.9°
CAP	CAM	HAM1	118.7°	120.1°
CAM	CAP	HAP1	120.2°	120.0°
CAN	CAL	CAM	117.0°	119.9°
CAN	CAL	OAA	119.9°	120.0°
CAL	CAN	HAN1	119.4°	120.1°
CAM	CAL	OAA	123.0°	120.1°
CAL	CAM	HAM1	118.7°	120.0°
CAL	OAA	CAK	117.8°	117.0°
OAA	CAK	OAB	119.3°	120.0°
OAA	CAK	CAI	123.4°	120.0°
OAB	CAK	CAI	117.2°	120.0°
CAK	CAI	CAG	119.8°	109.4°
CAK	CAI	HAI1	106.8°	109.4°
CAK	CAI	HAI2	106.8°	109.5°
CAI	CAG	CAF	117.5°	109.4°
CAI	CAG	HAG2	107.4°	109.5°
CAI	CAG	HAG1	107.4°	109.5°
CAG	CAI	HAI1	106.8°	109.5°
CAG	CAI	HAI2	106.8°	109.5°
CAG	CAF	CAH	113.2°	109.5°
CAG	CAF	HAF1	108.5°	109.5°
CAG	CAF	HAF2	108.5°	109.5°
CAF	CAG	HAG2	107.4°	109.4°
CAF	CAG	HAG1	107.4°	109.4°
CAF	CAH	CAJ	114.2°	109.5°
CAH	CAF	HAF1	108.5°	109.5°
CAH	CAF	HAF2	108.6°	109.4°
CAF	CAH	HAH1	108.3°	109.5°
CAF	CAH	HAH2	108.3°	109.4°
CAJ	CAH	HAH1	108.3°	109.5°
CAJ	CAH	HAH2	108.3°	109.5°
CAH	CAJ	HAJ2	109.5°	109.5°
CAH	CAJ	HAJ3	109.5°	109.5°
CAH	CAJ	HAJ1	109.5°	109.5°
HAF1	CAF	HAF2	109.4°	109.4°
HAG2	CAG	HAG1	109.5°	109.5°
HAH1	CAH	HAH2	109.5°	109.4°
HAI1	CAI	HAI2	109.5°	109.5°
HAJ2	CAJ	HAJ3	109.5°	109.5°
HAJ2	CAJ	HAJ1	109.5°	109.4°
HAJ3	CAJ	HAJ1	109.4°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OAD	NAE	OAC	CAO	178.4°	180.0°
OAD	NAE	CAO	CAQ	6.4°	180.0°
OAD	NAE	CAO	CAP	173.9°	0.3°
OAC	NAE	CAO	CAQ	172.0°	0.0°
OAC	NAE	CAO	CAP	7.7°	179.7°
NAE	CAO	CAQ	CAP	179.7°	179.8°
NAE	CAO	CAQ	CAN	179.9°	180.0°
NAE	CAO	CAP	CAM	179.8°	180.0°
NAE	CAO	CAP	HAP1	0.2°	0.3°
NAE	CAO	CAQ	HAQ1	0.0°	0.3°
CAO	CAQ	CAN	HAQ1	180.0°	179.7°
CAQ	CAO	CAP	CAM	0.1°	0.3°
CAO	CAQ	CAN	CAL	1.3°	0.0°
CAO	CAQ	CAN	HAN1	178.7°	180.0°
CAQ	CAO	CAP	HAP1	179.9°	180.0°
CAP	CAO	CAQ	CAN	0.4°	0.3°
CAO	CAP	CAM	HAP1	180.0°	179.7°
CAO	CAP	CAM	CAL	0.7°	0.0°
CAO	CAP	CAM	HAM1	179.3°	180.0°
CAP	CAO	CAQ	HAQ1	179.6°	180.0°
CAQ	CAN	CAL	HAN1	180.0°	180.0°
CAQ	CAN	CAL	CAM	1.8°	0.2°
CAQ	CAN	CAL	OAA	179.6°	180.0°
CAP	CAM	CAL	CAN	1.5°	0.2°
CAP	CAM	CAL	HAM1	180.0°	179.9°
CAP	CAM	CAL	OAA	179.9°	180.0°
CAN	CAL	CAM	OAA	178.6°	179.8°
CAN	CAL	OAA	CAK	150.9°	103.2°
CAN	CAL	CAM	HAM1	178.5°	179.7°
CAL	CAN	CAQ	HAQ1	178.7°	179.7°
CAM	CAL	OAA	CAK	30.6°	77.0°
CAM	CAL	CAN	HAN1	178.2°	179.7°
CAL	CAM	CAP	HAP1	179.3°	179.8°
CAL	OAA	CAK	OAB	83.1°	4.9°
CAL	OAA	CAK	CAI	99.9°	175.1°
OAA	CAL	CAM	HAM1	0.1°	0.1°
OAA	CAL	CAN	HAN1	0.4°	0.1°
OAA	CAK	OAB	CAI	177.2°	180.0°
OAA	CAK	CAI	CAG	142.1°	180.0°
OAA	CAK	CAI	HAI1	96.5°	60.0°
OAA	CAK	CAI	HAI2	20.6°	60.0°
OAB	CAK	CAI	CAG	40.9°	0.0°
OAB	CAK	CAI	HAI1	80.6°	120.0°
OAB	CAK	CAI	HAI2	162.3°	120.0°
CAK	CAI	CAG	HAI1	121.5°	119.9°
CAK	CAI	CAG	HAI2	121.5°	120.0°
CAK	CAI	CAG	CAF	60.0°	180.0°
CAK	CAI	CAG	HAG2	178.8°	60.1°
CAK	CAI	CAG	HAG1	61.1°	60.0°
CAK	CAI	HAI1	HAI2	115.3°	120.0°
CAI	CAG	CAF	HAG2	121.2°	119.9°
CAI	CAG	CAF	HAG1	121.2°	120.0°
CAI	CAG	CAF	CAH	81.8°	180.0°
CAI	CAG	CAF	HAF1	157.7°	60.0°
CAI	CAG	CAF	HAF2	38.8°	60.0°
CAI	CAG	HAG2	HAG1	116.4°	120.1°
CAG	CAI	HAI1	HAI2	115.3°	120.1°
CAG	CAF	CAH	HAF1	120.5°	120.1°
CAG	CAF	CAH	HAF2	120.6°	120.0°
CAG	CAF	CAH	CAJ	70.2°	180.0°
CAG	CAF	HAF1	HAF2	118.3°	120.0°
CAF	CAG	HAG2	HAG1	116.3°	120.0°
CAG	CAF	CAH	HAH1	169.0°	59.9°
CAG	CAF	CAH	HAH2	50.5°	60.0°
CAF	CAG	CAI	HAI1	61.5°	60.1°
CAF	CAG	CAI	HAI2	178.5°	60.0°
CAF	CAH	CAJ	HAH1	120.7°	120.1°
CAF	CAH	CAJ	HAH2	120.7°	120.0°
CAH	CAF	HAF1	HAF2	118.3°	119.9°
CAH	CAF	CAG	HAG2	39.4°	60.1°
CAH	CAF	CAG	HAG1	157.1°	60.0°
CAF	CAH	HAH1	HAH2	117.9°	119.9°
CAF	CAH	CAJ	HAJ2	180.0°	60.0°
CAF	CAH	CAJ	HAJ3	60.0°	60.0°
CAF	CAH	CAJ	HAJ1	60.0°	180.0°
CAJ	CAH	CAF	HAF1	50.3°	59.9°
CAJ	CAH	CAF	HAF2	169.2°	60.0°
CAJ	CAH	HAH1	HAH2	117.8°	120.0°
CAH	CAJ	HAJ2	HAJ3	120.0°	120.0°
CAH	CAJ	HAJ2	HAJ1	120.0°	120.0°
CAH	CAJ	HAJ3	HAJ1	120.0°	120.1°
HAF1	CAF	CAG	HAG2	81.1°	60.0°
HAF1	CAF	CAG	HAG1	36.5°	180.0°
HAF1	CAF	CAH	HAH1	70.4°	180.0°
HAF1	CAF	CAH	HAH2	171.0°	60.1°
HAF2	CAF	CAG	HAG2	160.0°	180.0°
HAF2	CAF	CAG	HAG1	82.3°	60.0°
HAF2	CAF	CAH	HAH1	48.5°	60.1°
HAF2	CAF	CAH	HAH2	70.1°	180.0°
HAG2	CAG	CAI	HAI1	59.7°	180.0°
HAG2	CAG	CAI	HAI2	57.4°	59.9°
HAG1	CAG	CAI	HAI1	177.4°	59.9°
HAG1	CAG	CAI	HAI2	60.3°	180.0°
HAH1	CAH	CAJ	HAJ2	59.3°	180.0°
HAH1	CAH	CAJ	HAJ3	179.4°	60.1°
HAH1	CAH	CAJ	HAJ1	60.7°	60.0°
HAH2	CAH	CAJ	HAJ2	59.3°	60.0°
HAH2	CAH	CAJ	HAJ3	60.8°	180.0°
HAH2	CAH	CAJ	HAJ1	179.3°	60.0°
HAJ2	CAJ	HAJ3	HAJ1	120.0°	119.9°
HAM1	CAM	CAP	HAP1	0.7°	0.3°
HAN1	CAN	CAQ	HAQ1	1.2°	0.3°

Release date:	2020-07-08
Definition date:	2019-07-17
Last modified:	2020-07-03
Release status:	REL
Processing site:	PDBJ
Derived from:	6KEU