2Q0

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAG	CAI	doub	1.38Å	1.39Å	Aromatic
CAG	CAM	sing	1.39Å	1.39Å	Aromatic
CAI	CAN	sing	1.40Å	1.39Å	Aromatic
OAD	CAM	sing	1.36Å	1.36Å
CAM	CAH	doub	1.39Å	1.39Å	Aromatic
CAA	CAR	sing	1.53Å	1.53Å
CAN	CAF	sing	1.47Å	1.40Å
CAN	CAJ	doub	1.40Å	1.39Å	Aromatic
CAB	CAR	sing	1.53Å	1.53Å
CAF	CAQ	doub	1.36Å	1.35Å
OAC	CAO	doub	1.22Å	1.23Å
CAH	CAJ	sing	1.38Å	1.39Å	Aromatic
CAR	CAK	sing	1.53Å	1.55Å
CAQ	CAO	sing	1.47Å	1.34Å
CAQ	SAL	sing	1.77Å	1.66Å
CAO	NAS	sing	1.32Å	1.36Å
NAS	CAK	sing	1.46Å	1.51Å
NAS	CAP	sing	1.34Å	1.34Å
SAL	CAP	sing	1.77Å	1.62Å
CAP	SAE	doub	1.71Å	1.73Å
CAA	H1	sing	1.09Å	1.10Å
CAA	H2	sing	1.09Å	1.10Å
CAA	H3	sing	1.09Å	1.10Å
CAR	H4	sing	1.09Å	1.10Å
CAB	H5	sing	1.09Å	1.10Å
CAB	H6	sing	1.09Å	1.10Å
CAB	H7	sing	1.09Å	1.10Å
CAK	H8	sing	1.09Å	1.10Å
CAK	H9	sing	1.09Å	1.10Å
CAF	H10	sing	1.08Å	1.08Å
CAI	H12	sing	1.08Å	1.08Å
CAG	H13	sing	1.08Å	1.08Å
OAD	H14	sing	0.97Å	0.95Å
CAH	H15	sing	1.08Å	1.08Å
CAJ	H16	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAI	CAG	CAM	119.9°	120.1°
CAG	CAI	CAN	121.3°	119.8°
CAG	CAI	H12	119.3°	120.1°
CAI	CAG	H13	120.1°	119.9°
CAG	CAM	OAD	120.1°	119.8°
CAG	CAM	CAH	119.7°	120.3°
CAM	CAG	H13	120.1°	119.9°
CAI	CAN	CAF	116.0°	120.1°
CAI	CAN	CAJ	118.1°	119.8°
CAN	CAI	H12	119.4°	120.1°
OAD	CAM	CAH	120.2°	119.9°
CAM	OAD	H14	109.5°	114.0°
CAM	CAH	CAJ	119.9°	120.1°
CAM	CAH	H15	120.1°	119.9°
CAA	CAR	CAB	107.6°	109.5°
CAA	CAR	CAK	113.9°	109.5°
CAR	CAA	H1	109.5°	109.4°
CAR	CAA	H2	109.5°	109.5°
CAR	CAA	H3	109.5°	109.5°
CAA	CAR	H4	108.8°	109.4°
CAF	CAN	CAJ	125.9°	120.1°
CAN	CAF	CAQ	125.6°	120.0°
CAN	CAF	H10	117.2°	120.0°
CAN	CAJ	CAH	121.2°	119.9°
CAN	CAJ	H16	119.4°	120.1°
CAB	CAR	CAK	109.3°	109.5°
CAB	CAR	H4	108.7°	109.5°
CAR	CAB	H5	109.5°	109.4°
CAR	CAB	H6	109.5°	109.5°
CAR	CAB	H7	109.5°	109.5°
CAF	CAQ	CAO	120.4°	127.9°
CAF	CAQ	SAL	132.3°	128.0°
CAQ	CAF	H10	117.2°	120.0°
OAC	CAO	CAQ	120.5°	122.5°
OAC	CAO	NAS	124.0°	122.5°
CAJ	CAH	H15	120.0°	120.0°
CAH	CAJ	H16	119.4°	120.0°
CAR	CAK	NAS	118.0°	109.5°
CAK	CAR	H4	108.5°	109.4°
CAR	CAK	H8	107.3°	109.5°
CAR	CAK	H9	107.3°	109.5°
CAO	CAQ	SAL	107.3°	104.1°
CAQ	CAO	NAS	115.6°	114.9°
CAQ	SAL	CAP	94.9°	94.6°
CAO	NAS	CAK	135.5°	120.2°
CAO	NAS	CAP	111.3°	119.5°
CAK	NAS	CAP	113.2°	120.2°
NAS	CAK	H8	107.3°	109.4°
NAS	CAK	H9	107.3°	109.5°
NAS	CAP	SAL	110.8°	106.9°
NAS	CAP	SAE	124.9°	126.6°
SAL	CAP	SAE	124.3°	126.6°
H1	CAA	H2	109.5°	109.5°
H1	CAA	H3	109.4°	109.4°
H2	CAA	H3	109.5°	109.5°
H5	CAB	H6	109.4°	109.4°
H5	CAB	H7	109.5°	109.5°
H6	CAB	H7	109.5°	109.5°
H8	CAK	H9	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CAI	CAG	CAM	H13	180.0°	180.0°
CAG	CAI	CAN	H12	180.0°	179.9°
CAI	CAG	CAM	OAD	180.0°	180.0°
CAI	CAG	CAM	CAH	0.2°	0.0°
CAG	CAI	CAN	CAF	179.8°	180.0°
CAG	CAI	CAN	CAJ	0.5°	0.4°
CAM	CAG	CAI	CAN	0.3°	0.0°
CAG	CAM	OAD	CAH	179.8°	180.0°
CAG	CAM	CAH	CAJ	0.2°	0.2°
CAM	CAG	CAI	H12	179.7°	179.9°
CAG	CAM	OAD	H14	180.0°	90.0°
CAG	CAM	CAH	H15	179.9°	180.0°
CAI	CAN	CAF	CAJ	179.2°	179.7°
CAI	CAN	CAF	CAQ	179.0°	21.5°
CAI	CAN	CAJ	CAH	0.5°	0.6°
CAI	CAN	CAF	H10	1.0°	158.5°
CAN	CAI	CAG	H13	179.7°	180.0°
CAI	CAN	CAJ	H16	179.5°	179.7°
OAD	CAM	CAH	CAJ	180.0°	179.7°
OAD	CAM	CAG	H13	0.0°	0.0°
OAD	CAM	CAH	H15	0.1°	0.1°
CAM	CAH	CAJ	CAN	0.3°	0.5°
CAM	CAH	CAJ	H15	180.0°	179.8°
CAH	CAM	CAG	H13	179.8°	180.0°
CAH	CAM	OAD	H14	0.2°	90.0°
CAM	CAH	CAJ	H16	179.7°	179.8°
CAA	CAR	CAB	CAK	124.1°	120.0°
CAA	CAR	CAB	H4	117.7°	120.0°
CAA	CAR	CAK	H4	121.3°	119.9°
CAA	CAR	CAK	NAS	63.7°	65.0°
CAR	CAA	H1	H2	120.0°	120.0°
CAR	CAA	H1	H3	120.0°	120.0°
CAR	CAA	H2	H3	120.0°	120.1°
CAA	CAR	CAB	H5	180.0°	60.1°
CAA	CAR	CAB	H6	60.0°	180.0°
CAA	CAR	CAB	H7	60.0°	60.0°
CAA	CAR	CAK	H8	175.1°	175.0°
CAA	CAR	CAK	H9	57.5°	55.1°
CAN	CAF	CAQ	H10	180.0°	180.0°
CAF	CAN	CAJ	CAH	179.7°	179.7°
CAN	CAF	CAQ	CAO	179.4°	172.9°
CAN	CAF	CAQ	SAL	0.9°	7.3°
CAF	CAN	CAI	H12	0.2°	0.1°
CAF	CAN	CAJ	H16	0.3°	0.1°
CAJ	CAN	CAF	CAQ	0.2°	158.8°
CAN	CAJ	CAH	H16	180.0°	179.7°
CAJ	CAN	CAF	H10	179.8°	21.2°
CAJ	CAN	CAI	H12	179.5°	179.7°
CAN	CAJ	CAH	H15	179.7°	179.6°
CAB	CAR	CAK	H4	118.4°	120.0°
CAB	CAR	CAK	NAS	56.6°	175.0°
CAB	CAR	CAA	H1	180.0°	60.1°
CAB	CAR	CAA	H2	60.0°	60.0°
CAB	CAR	CAA	H3	60.0°	180.0°
CAR	CAB	H5	H6	120.0°	120.0°
CAR	CAB	H5	H7	120.0°	120.0°
CAR	CAB	H6	H7	120.0°	120.1°
CAB	CAR	CAK	H8	64.6°	55.0°
CAB	CAR	CAK	H9	177.8°	65.0°
CAF	CAQ	CAO	OAC	0.0°	0.0°
CAF	CAQ	CAO	SAL	179.8°	179.9°
CAF	CAQ	CAO	NAS	179.6°	180.0°
CAF	CAQ	SAL	CAP	180.0°	179.9°
OAC	CAO	CAQ	NAS	179.6°	180.0°
OAC	CAO	CAQ	SAL	179.7°	179.9°
OAC	CAO	NAS	CAK	0.9°	0.0°
OAC	CAO	NAS	CAP	179.6°	179.7°
CAR	CAK	NAS	CAO	56.0°	89.7°
CAR	CAK	NAS	H8	121.2°	120.0°
CAR	CAK	NAS	H9	121.2°	120.0°
CAR	CAK	NAS	CAP	125.3°	90.0°
CAK	CAR	CAA	H1	58.7°	60.0°
CAK	CAR	CAA	H2	178.8°	180.0°
CAK	CAR	CAA	H3	61.2°	59.9°
CAK	CAR	CAB	H5	55.9°	60.0°
CAK	CAR	CAB	H6	64.1°	60.0°
CAK	CAR	CAB	H7	175.9°	180.0°
CAR	CAK	H8	H9	116.1°	120.0°
CAQ	CAO	NAS	CAK	179.6°	180.0°
CAQ	CAO	NAS	CAP	0.9°	0.3°
CAO	CAQ	SAL	CAP	0.3°	0.0°
CAO	CAQ	CAF	H10	0.6°	7.2°
SAL	CAQ	CAO	NAS	0.7°	0.1°
CAQ	SAL	CAP	NAS	0.2°	0.1°
CAQ	SAL	CAP	SAE	179.9°	179.8°
SAL	CAQ	CAF	H10	179.1°	172.7°
CAO	NAS	CAK	CAP	178.7°	179.7°
CAO	NAS	CAP	SAL	0.6°	0.2°
CAO	NAS	CAP	SAE	179.7°	179.7°
CAO	NAS	CAK	H8	177.3°	150.3°
CAO	NAS	CAK	H9	65.2°	30.3°
CAK	NAS	CAP	SAL	179.6°	180.0°
CAK	NAS	CAP	SAE	0.7°	0.0°
NAS	CAK	CAR	H4	175.0°	55.0°
NAS	CAK	H8	H9	116.1°	120.0°
NAS	CAP	SAL	SAE	179.7°	180.0°
CAP	NAS	CAK	H8	4.1°	30.0°
CAP	NAS	CAK	H9	113.5°	150.0°
H1	CAA	H2	H3	120.0°	120.0°
H1	CAA	CAR	H4	62.4°	179.9°
H2	CAA	CAR	H4	57.6°	60.1°
H3	CAA	CAR	H4	177.6°	60.0°
H4	CAR	CAB	H5	62.4°	180.0°
H4	CAR	CAB	H6	177.7°	60.0°
H4	CAR	CAB	H7	57.7°	60.0°
H4	CAR	CAK	H8	53.7°	65.0°
H4	CAR	CAK	H9	63.8°	175.0°
H5	CAB	H6	H7	120.0°	120.0°
H12	CAI	CAG	H13	0.3°	0.1°
H15	CAH	CAJ	H16	0.3°	0.0°

Release date:	2014-01-15
Definition date:	2013-12-29
Last modified:	2020-02-12
Release status:	REL
Processing site:	RCSB
Derived from:	4O24