0G2

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAV	CAU	doub	1.38Å	1.40Å	Aromatic
CAV	CAW	sing	1.38Å	1.39Å	Aromatic
CAU	CAT	sing	1.38Å	1.40Å	Aromatic
CAW	CAX	doub	1.38Å	1.40Å	Aromatic
CAT	CAR	doub	1.40Å	1.40Å	Aromatic
CAX	CAR	sing	1.40Å	1.40Å	Aromatic
CAR	CAP	sing	1.48Å	1.40Å
CAP	CAO	doub	1.33Å	1.34Å	Aromatic
CAP	SAQ	sing	1.75Å	1.68Å	Aromatic
CAO	CAN	sing	1.46Å	1.35Å	Aromatic
SAQ	CAM	sing	1.76Å	1.68Å	Aromatic
CAN	CAM	sing	1.40Å	1.39Å	Aromatic
CAN	NAL	doub	1.34Å	1.34Å	Aromatic
CAM	CAJ	doub	1.39Å	1.38Å	Aromatic
NAL	NAK	sing	1.40Å	1.24Å	Aromatic
CAJ	NAK	sing	1.36Å	1.33Å	Aromatic
CAJ	CAA	sing	1.47Å	1.40Å
CAB	CAA	doub	1.36Å	1.34Å	Aromatic
CAB	CAE	sing	1.46Å	1.33Å	Aromatic
CAA	NAC	sing	1.38Å	1.33Å	Aromatic
CAE	CAF	doub	1.40Å	1.39Å	Aromatic
CAE	CAD	sing	1.41Å	1.39Å	Aromatic
NAC	CAD	sing	1.38Å	1.33Å	Aromatic
CAF	CAG	sing	1.37Å	1.40Å	Aromatic
CAD	CAI	doub	1.39Å	1.40Å	Aromatic
CAG	CAH	doub	1.39Å	1.40Å	Aromatic
CAI	CAH	sing	1.38Å	1.40Å	Aromatic
CAH	CAS	sing	1.51Å	1.55Å
CAS	OBA	sing	1.43Å	1.44Å
CAS	CAY	sing	1.53Å	1.54Å
CAS	CAZ	sing	1.53Å	1.54Å
CAY	CBB	sing	1.53Å	1.53Å
CAZ	CBC	sing	1.53Å	1.54Å
CBB	H1	sing	1.09Å	1.10Å
CBB	H2	sing	1.09Å	1.10Å
CBB	H3	sing	1.09Å	1.10Å
CAY	H4	sing	1.09Å	1.10Å
CAY	H5	sing	1.09Å	1.10Å
CAZ	H6	sing	1.09Å	1.10Å
CAZ	H7	sing	1.09Å	1.10Å
CBC	H8	sing	1.09Å	1.10Å
CBC	H9	sing	1.09Å	1.10Å
CBC	H10	sing	1.09Å	1.10Å
OBA	H11	sing	0.97Å	0.95Å
CAI	H12	sing	1.08Å	1.08Å
CAG	H13	sing	1.08Å	1.08Å
CAF	H14	sing	1.08Å	1.08Å
CAB	H15	sing	1.08Å	1.08Å
NAC	H16	sing	0.97Å	1.00Å
NAK	H17	sing	0.97Å	1.00Å
CAO	H18	sing	1.08Å	1.08Å
CAT	H19	sing	1.08Å	1.08Å
CAU	H20	sing	1.08Å	1.08Å
CAV	H21	sing	1.08Å	1.08Å
CAW	H22	sing	1.08Å	1.08Å
CAX	H23	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAU	CAV	CAW	119.8°	120.3°
CAV	CAU	CAT	120.2°	120.1°
CAV	CAU	H20	119.9°	119.9°
CAU	CAV	H21	120.1°	119.8°
CAV	CAW	CAX	120.0°	120.2°
CAW	CAV	H21	120.1°	119.9°
CAV	CAW	H22	120.0°	119.9°
CAU	CAT	CAR	120.3°	119.9°
CAU	CAT	H19	119.9°	120.1°
CAT	CAU	H20	119.9°	119.9°
CAW	CAX	CAR	120.5°	119.8°
CAX	CAW	H22	120.0°	119.9°
CAW	CAX	H23	119.7°	120.1°
CAT	CAR	CAX	119.2°	119.7°
CAT	CAR	CAP	120.3°	120.1°
CAR	CAT	H19	119.8°	120.1°
CAX	CAR	CAP	120.5°	120.1°
CAR	CAX	H23	119.8°	120.1°
CAR	CAP	CAO	129.6°	124.3°
CAR	CAP	SAQ	123.0°	124.3°
CAO	CAP	SAQ	107.4°	111.5°
CAP	CAO	CAN	116.1°	114.6°
CAP	CAO	H18	122.0°	122.7°
CAP	SAQ	CAM	96.1°	92.3°
CAO	CAN	CAM	113.3°	111.8°
CAO	CAN	NAL	141.7°	140.4°
CAN	CAO	H18	122.0°	122.7°
SAQ	CAM	CAN	107.1°	109.9°
SAQ	CAM	CAJ	147.2°	142.4°
CAM	CAN	NAL	105.0°	107.8°
CAN	CAM	CAJ	105.6°	107.8°
CAN	NAL	NAK	112.3°	109.0°
CAM	CAJ	NAK	106.7°	107.2°
CAM	CAJ	CAA	124.4°	126.4°
NAL	NAK	CAJ	110.4°	108.3°
NAL	NAK	H17	124.8°	125.9°
NAK	CAJ	CAA	128.9°	126.4°
CAJ	NAK	H17	124.8°	125.8°
CAJ	CAA	CAB	126.2°	125.3°
CAJ	CAA	NAC	125.3°	125.3°
CAA	CAB	CAE	108.7°	107.0°
CAB	CAA	NAC	108.5°	109.5°
CAA	CAB	H15	125.7°	126.5°
CAB	CAE	CAF	132.7°	133.8°
CAB	CAE	CAD	107.1°	106.3°
CAE	CAB	H15	125.6°	126.5°
CAA	NAC	CAD	108.8°	109.8°
CAA	NAC	H16	125.6°	125.1°
CAF	CAE	CAD	120.2°	119.9°
CAE	CAF	CAG	119.7°	119.8°
CAE	CAF	H14	120.1°	120.1°
CAE	CAD	NAC	106.9°	107.5°
CAE	CAD	CAI	120.1°	119.3°
NAC	CAD	CAI	133.0°	133.2°
CAD	NAC	H16	125.6°	125.2°
CAF	CAG	CAH	120.6°	120.5°
CAF	CAG	H13	119.7°	119.7°
CAG	CAF	H14	120.1°	120.1°
CAD	CAI	CAH	120.2°	119.8°
CAD	CAI	H12	119.9°	120.1°
CAG	CAH	CAI	119.2°	120.7°
CAG	CAH	CAS	119.6°	119.7°
CAH	CAG	H13	119.7°	119.7°
CAI	CAH	CAS	121.2°	119.7°
CAH	CAI	H12	119.9°	120.1°
CAH	CAS	OBA	109.3°	109.5°
CAH	CAS	CAY	109.4°	109.5°
CAH	CAS	CAZ	111.2°	109.5°
OBA	CAS	CAY	107.5°	109.5°
OBA	CAS	CAZ	109.9°	109.4°
CAS	OBA	H11	109.5°	114.0°
CAY	CAS	CAZ	109.5°	109.5°
CAS	CAY	CBB	113.1°	109.5°
CAS	CAY	H4	108.6°	109.5°
CAS	CAY	H5	108.6°	109.5°
CAS	CAZ	CBC	113.3°	109.5°
CAS	CAZ	H6	108.5°	109.5°
CAS	CAZ	H7	108.5°	109.4°
CAY	CBB	H1	109.5°	109.4°
CAY	CBB	H2	109.5°	109.5°
CAY	CBB	H3	109.5°	109.5°
CBB	CAY	H4	108.5°	109.5°
CBB	CAY	H5	108.6°	109.5°
CBC	CAZ	H6	108.5°	109.5°
CBC	CAZ	H7	108.5°	109.4°
CAZ	CBC	H8	109.5°	109.4°
CAZ	CBC	H9	109.5°	109.5°
CAZ	CBC	H10	109.5°	109.5°
H1	CBB	H2	109.5°	109.5°
H1	CBB	H3	109.4°	109.5°
H2	CBB	H3	109.5°	109.5°
H4	CAY	H5	109.5°	109.5°
H6	CAZ	H7	109.5°	109.5°
H8	CBC	H9	109.5°	109.4°
H8	CBC	H10	109.5°	109.5°
H9	CBC	H10	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CAU	CAV	CAW	H21	180.0°	180.0°
CAV	CAU	CAT	H20	180.0°	180.0°
CAU	CAV	CAW	CAX	0.3°	0.3°
CAV	CAU	CAT	CAR	0.3°	0.0°
CAV	CAU	CAT	H19	179.7°	179.9°
CAU	CAV	CAW	H22	179.7°	180.0°
CAW	CAV	CAU	CAT	0.6°	0.0°
CAV	CAW	CAX	H22	180.0°	179.7°
CAV	CAW	CAX	CAR	0.3°	0.6°
CAW	CAV	CAU	H20	179.5°	180.0°
CAV	CAW	CAX	H23	179.7°	179.9°
CAU	CAT	CAR	H19	180.0°	180.0°
CAU	CAT	CAR	CAX	0.3°	0.2°
CAU	CAT	CAR	CAP	178.8°	180.0°
CAT	CAU	CAV	H21	179.5°	180.0°
CAW	CAX	CAR	CAT	0.6°	0.5°
CAW	CAX	CAR	H23	180.0°	179.5°
CAW	CAX	CAR	CAP	179.1°	179.7°
CAX	CAW	CAV	H21	179.7°	179.7°
CAT	CAR	CAX	CAP	178.5°	179.7°
CAT	CAR	CAP	CAO	14.8°	180.0°
CAT	CAR	CAP	SAQ	162.6°	0.4°
CAR	CAT	CAU	H20	179.7°	180.0°
CAT	CAR	CAX	H23	179.4°	180.0°
CAX	CAR	CAP	CAO	166.7°	0.3°
CAX	CAR	CAP	SAQ	15.9°	179.3°
CAX	CAR	CAT	H19	179.7°	179.8°
CAR	CAX	CAW	H22	179.7°	179.7°
CAR	CAP	CAO	SAQ	177.7°	179.6°
CAR	CAP	CAO	CAN	178.4°	180.0°
CAR	CAP	SAQ	CAM	178.5°	179.9°
CAR	CAP	CAO	H18	1.6°	0.0°
CAP	CAR	CAT	H19	1.2°	0.0°
CAP	CAR	CAX	H23	0.9°	0.2°
CAP	CAO	CAN	H18	180.0°	179.9°
CAO	CAP	SAQ	CAM	0.6°	0.5°
CAP	CAO	CAN	CAM	0.5°	0.1°
CAP	CAO	CAN	NAL	179.5°	179.4°
SAQ	CAP	CAO	CAN	0.7°	0.3°
CAP	SAQ	CAM	CAN	0.4°	0.5°
CAP	SAQ	CAM	CAJ	179.7°	179.8°
SAQ	CAP	CAO	H18	179.3°	179.6°
CAO	CAN	CAM	SAQ	0.0°	0.4°
CAO	CAN	CAM	NAL	179.4°	179.5°
CAO	CAN	CAM	CAJ	179.7°	180.0°
CAO	CAN	NAL	NAK	179.7°	179.6°
SAQ	CAM	CAN	CAJ	179.6°	179.6°
SAQ	CAM	CAN	NAL	179.4°	180.0°
SAQ	CAM	CAJ	NAK	180.0°	179.8°
SAQ	CAM	CAJ	CAA	1.6°	0.5°
CAM	CAN	NAL	NAK	1.2°	0.3°
CAN	CAM	CAJ	NAK	0.6°	0.5°
CAN	CAM	CAJ	CAA	179.1°	179.8°
CAM	CAN	CAO	H18	179.5°	180.0°
NAL	CAN	CAM	CAJ	0.3°	0.5°
CAN	NAL	NAK	CAJ	1.7°	0.0°
CAN	NAL	NAK	H17	178.3°	179.9°
NAL	CAN	CAO	H18	0.5°	0.7°
CAM	CAJ	NAK	NAL	1.4°	0.3°
CAM	CAJ	NAK	CAA	178.4°	179.7°
CAM	CAJ	CAA	CAB	0.7°	140.3°
CAM	CAJ	CAA	NAC	179.9°	39.5°
CAM	CAJ	NAK	H17	178.6°	179.8°
NAL	NAK	CAJ	H17	180.0°	179.9°
NAL	NAK	CAJ	CAA	179.8°	180.0°
NAK	CAJ	CAA	CAB	177.4°	40.0°
NAK	CAJ	CAA	NAC	1.7°	140.1°
CAJ	CAA	CAB	NAC	179.3°	179.8°
CAJ	CAA	CAB	CAE	179.8°	180.0°
CAJ	CAA	NAC	CAD	179.0°	179.9°
CAJ	CAA	CAB	H15	0.1°	0.1°
CAJ	CAA	NAC	H16	0.9°	0.0°
CAA	CAJ	NAK	H17	0.2°	0.1°
CAA	CAB	CAE	H15	180.0°	180.0°
CAA	CAB	CAE	CAF	179.6°	180.0°
CAA	CAB	CAE	CAD	1.1°	0.2°
CAB	CAA	NAC	CAD	0.3°	0.0°
CAB	CAA	NAC	H16	179.7°	179.8°
CAE	CAB	CAA	NAC	0.5°	0.2°
CAB	CAE	CAF	CAD	178.3°	179.7°
CAB	CAE	CAD	NAC	1.3°	0.2°
CAB	CAE	CAF	CAG	179.3°	180.0°
CAB	CAE	CAD	CAI	179.5°	180.0°
CAB	CAE	CAF	H14	0.7°	0.0°
CAA	NAC	CAD	CAE	0.9°	0.1°
CAA	NAC	CAD	H16	180.0°	179.9°
CAA	NAC	CAD	CAI	178.9°	179.8°
NAC	CAA	CAB	H15	179.4°	179.8°
CAF	CAE	CAD	NAC	180.0°	180.0°
CAE	CAF	CAG	H14	180.0°	179.9°
CAF	CAE	CAD	CAI	1.7°	0.2°
CAE	CAF	CAG	CAH	0.3°	0.1°
CAE	CAF	CAG	H13	179.6°	179.9°
CAF	CAE	CAB	H15	0.4°	0.0°
CAE	CAD	NAC	CAI	178.0°	179.7°
CAD	CAE	CAF	CAG	0.9°	0.3°
CAE	CAD	CAI	CAH	1.3°	0.0°
CAE	CAD	CAI	H12	178.7°	179.9°
CAD	CAE	CAF	H14	179.1°	179.8°
CAD	CAE	CAB	H15	178.9°	179.7°
CAE	CAD	NAC	H16	179.1°	180.0°
NAC	CAD	CAI	CAH	179.0°	179.6°
NAC	CAD	CAI	H12	1.0°	0.3°
CAF	CAG	CAH	H13	180.0°	179.9°
CAF	CAG	CAH	CAI	0.8°	0.2°
CAF	CAG	CAH	CAS	179.6°	180.0°
CAD	CAI	CAH	CAG	0.0°	0.3°
CAD	CAI	CAH	H12	180.0°	179.9°
CAD	CAI	CAH	CAS	178.7°	180.0°
CAI	CAD	NAC	H16	1.1°	0.3°
CAG	CAH	CAI	CAS	178.8°	179.8°
CAG	CAH	CAS	OBA	26.4°	149.8°
CAG	CAH	CAS	CAY	91.0°	29.8°
CAG	CAH	CAS	CAZ	147.9°	90.3°
CAG	CAH	CAI	H12	180.0°	179.8°
CAH	CAG	CAF	H14	179.7°	180.0°
CAI	CAH	CAS	OBA	154.8°	30.0°
CAI	CAH	CAS	CAY	87.8°	150.0°
CAI	CAH	CAS	CAZ	33.3°	90.0°
CAI	CAH	CAG	H13	179.2°	179.6°
CAH	CAS	OBA	CAY	118.6°	120.0°
CAH	CAS	OBA	CAZ	122.3°	120.0°
CAH	CAS	CAY	CAZ	122.1°	120.0°
CAH	CAS	CAY	CBB	68.6°	60.8°
CAH	CAS	CAZ	CBC	102.5°	179.4°
CAH	CAS	CAY	H4	170.9°	59.2°
CAH	CAS	CAY	H5	52.0°	179.2°
CAH	CAS	CAZ	H6	137.0°	59.4°
CAH	CAS	CAZ	H7	18.1°	60.6°
CAH	CAS	OBA	H11	180.0°	60.0°
CAS	CAH	CAI	H12	1.3°	0.1°
CAS	CAH	CAG	H13	0.4°	0.1°
OBA	CAS	CAY	CAZ	119.4°	120.0°
OBA	CAS	CAY	CBB	172.9°	59.2°
OBA	CAS	CAZ	CBC	18.7°	59.4°
OBA	CAS	CAY	H4	52.4°	179.2°
OBA	CAS	CAY	H5	66.5°	60.8°
OBA	CAS	CAZ	H6	101.9°	60.6°
OBA	CAS	CAZ	H7	139.3°	179.4°
CAS	CAY	CBB	H4	120.5°	120.0°
CAS	CAY	CBB	H5	120.6°	120.0°
CAY	CAS	CAZ	CBC	136.5°	60.6°
CAS	CAY	CBB	H1	180.0°	174.8°
CAS	CAY	CBB	H2	60.0°	65.2°
CAS	CAY	CBB	H3	60.0°	54.8°
CAS	CAY	H4	H5	118.4°	120.0°
CAY	CAS	CAZ	H6	16.0°	179.4°
CAY	CAS	CAZ	H7	102.9°	59.4°
CAY	CAS	OBA	H11	61.4°	180.0°
CAZ	CAS	CAY	CBB	53.5°	179.2°
CAS	CAZ	CBC	H6	120.6°	120.0°
CAS	CAZ	CBC	H7	120.6°	119.9°
CAZ	CAS	CAY	H4	67.0°	60.8°
CAZ	CAS	CAY	H5	174.1°	59.2°
CAS	CAZ	H6	H7	118.2°	120.0°
CAS	CAZ	CBC	H8	180.0°	54.3°
CAS	CAZ	CBC	H9	60.0°	174.3°
CAS	CAZ	CBC	H10	60.0°	65.7°
CAZ	CAS	OBA	H11	57.7°	60.0°
CAY	CBB	H1	H2	120.0°	120.0°
CAY	CBB	H1	H3	120.0°	120.0°
CAY	CBB	H2	H3	120.0°	120.0°
CBB	CAY	H4	H5	118.4°	120.0°
CBC	CAZ	H6	H7	118.2°	120.0°
CAZ	CBC	H8	H9	120.0°	120.0°
CAZ	CBC	H8	H10	120.0°	120.0°
CAZ	CBC	H9	H10	120.0°	120.0°
H1	CBB	H2	H3	120.0°	120.1°
H1	CBB	CAY	H4	59.5°	65.2°
H1	CBB	CAY	H5	59.5°	54.8°
H2	CBB	CAY	H4	179.5°	54.8°
H2	CBB	CAY	H5	60.6°	174.8°
H3	CBB	CAY	H4	60.5°	174.8°
H3	CBB	CAY	H5	179.4°	65.2°
H6	CAZ	CBC	H8	59.4°	65.7°
H6	CAZ	CBC	H9	179.4°	54.2°
H6	CAZ	CBC	H10	60.6°	174.3°
H7	CAZ	CBC	H8	59.4°	174.3°
H7	CAZ	CBC	H9	60.6°	65.8°
H7	CAZ	CBC	H10	179.4°	54.3°
H8	CBC	H9	H10	120.0°	120.0°
H13	CAG	CAF	H14	0.4°	0.1°
H19	CAT	CAU	H20	0.3°	0.0°
H20	CAU	CAV	H21	0.5°	0.0°
H21	CAV	CAW	H22	0.2°	0.0°
H22	CAW	CAX	H23	0.3°	0.2°

Definition date:	2012-01-05
Last modified:	2012-04-27
Release status:	REL
Processing site:	RCSB
Derived from:	3V8W