W7G

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAH	CAF	doub	1.38Å	1.42Å	Aromatic
CAH	CAP	sing	1.38Å	1.42Å	Aromatic
CAF	CAG	sing	1.38Å	1.40Å	Aromatic
CAJ	CAP	sing	1.51Å	1.44Å
CAJ	CAK	sing	1.53Å	1.53Å
CAP	CAQ	doub	1.39Å	1.42Å	Aromatic
CAG	CAI	doub	1.38Å	1.39Å	Aromatic
CAQ	CAI	sing	1.39Å	1.44Å	Aromatic
CAQ	OAN	sing	1.36Å	1.37Å
OAN	CAA	sing	1.43Å	1.50Å
CAK	CAS	sing	1.51Å	1.47Å
OAD	CAU	doub	1.22Å	1.25Å
CAS	CAU	sing	1.47Å	1.41Å
CAS	CAR	doub	1.36Å	1.37Å
CAU	NAM	sing	1.35Å	1.41Å
CAR	CAO	sing	1.48Å	1.43Å
CAR	NAL	sing	1.38Å	1.40Å
OAE	CAO	doub	1.21Å	1.26Å
CAO	OAB	sing	1.35Å	1.24Å
NAM	CAT	sing	1.35Å	1.38Å
NAL	CAT	sing	1.34Å	1.36Å
CAT	OAC	doub	1.22Å	1.23Å
OAB	H1	sing	0.97Å	0.95Å
NAM	H2	sing	0.97Å	1.00Å
CAK	H4	sing	1.09Å	1.10Å
CAK	H5	sing	1.09Å	1.10Å
CAJ	H6	sing	1.09Å	1.10Å
CAJ	H7	sing	1.09Å	1.10Å
CAH	H8	sing	1.08Å	1.08Å
CAF	H9	sing	1.08Å	1.08Å
CAG	H10	sing	1.08Å	1.08Å
CAI	H11	sing	1.08Å	1.08Å
CAA	H12	sing	1.09Å	1.10Å
CAA	H13	sing	1.09Å	1.10Å
CAA	H14	sing	1.09Å	1.10Å
NAL	H15	sing	0.97Å	1.00Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAF	CAH	CAP	121.2°	120.1°
CAH	CAF	CAG	119.2°	120.1°
CAF	CAH	H8	119.4°	120.0°
CAH	CAF	H9	120.4°	120.0°
CAH	CAP	CAJ	123.3°	120.0°
CAH	CAP	CAQ	117.8°	119.9°
CAP	CAH	H8	119.4°	120.0°
CAF	CAG	CAI	121.9°	120.1°
CAG	CAF	H9	120.4°	120.0°
CAF	CAG	H10	119.0°	119.9°
CAP	CAJ	CAK	109.2°	109.5°
CAJ	CAP	CAQ	118.9°	120.1°
CAP	CAJ	H6	109.5°	109.4°
CAP	CAJ	H7	109.5°	109.5°
CAJ	CAK	CAS	106.9°	109.5°
CAJ	CAK	H4	110.1°	109.5°
CAJ	CAK	H5	110.1°	109.5°
CAK	CAJ	H6	109.5°	109.5°
CAK	CAJ	H7	109.5°	109.5°
CAP	CAQ	CAI	120.9°	119.9°
CAP	CAQ	OAN	112.4°	120.0°
CAG	CAI	CAQ	118.9°	119.9°
CAI	CAG	H10	119.1°	120.0°
CAG	CAI	H11	120.5°	120.0°
CAI	CAQ	OAN	126.5°	120.1°
CAQ	CAI	H11	120.5°	120.1°
CAQ	OAN	CAA	117.4°	117.0°
OAN	CAA	H12	109.5°	109.5°
OAN	CAA	H13	109.4°	109.5°
OAN	CAA	H14	109.5°	109.5°
CAK	CAS	CAU	122.8°	120.8°
CAK	CAS	CAR	118.6°	120.8°
CAS	CAK	H4	110.1°	109.4°
CAS	CAK	H5	110.1°	109.5°
OAD	CAU	CAS	127.1°	120.6°
OAD	CAU	NAM	114.3°	120.6°
CAU	CAS	CAR	118.6°	118.4°
CAS	CAU	NAM	118.5°	118.8°
CAS	CAR	CAO	125.7°	120.3°
CAS	CAR	NAL	121.7°	119.4°
CAU	NAM	CAT	121.2°	120.4°
CAU	NAM	H2	119.4°	119.8°
CAO	CAR	NAL	112.6°	120.3°
CAR	CAO	OAE	119.3°	120.0°
CAR	CAO	OAB	116.6°	119.9°
CAR	NAL	CAT	120.5°	121.2°
CAR	NAL	H15	119.8°	119.5°
OAE	CAO	OAB	123.8°	120.0°
CAO	OAB	H1	109.5°	117.0°
NAM	CAT	NAL	119.3°	121.7°
NAM	CAT	OAC	119.9°	119.1°
CAT	NAM	H2	119.4°	119.8°
NAL	CAT	OAC	120.7°	119.1°
CAT	NAL	H15	119.8°	119.3°
H4	CAK	H5	109.5°	109.4°
H6	CAJ	H7	109.5°	109.4°
H12	CAA	H13	109.5°	109.5°
H12	CAA	H14	109.5°	109.4°
H13	CAA	H14	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CAF	CAH	CAP	H8	180.0°	180.0°
CAH	CAF	CAG	H9	180.0°	180.0°
CAF	CAH	CAP	CAJ	178.2°	180.0°
CAF	CAH	CAP	CAQ	2.3°	0.3°
CAH	CAF	CAG	CAI	3.1°	0.0°
CAH	CAF	CAG	H10	176.9°	180.0°
CAP	CAH	CAF	CAG	0.4°	0.0°
CAH	CAP	CAJ	CAQ	179.5°	179.8°
CAH	CAP	CAJ	CAK	79.4°	94.8°
CAH	CAP	CAQ	CAI	2.5°	0.5°
CAH	CAP	CAQ	OAN	177.5°	179.7°
CAH	CAP	CAJ	H6	160.7°	145.2°
CAH	CAP	CAJ	H7	40.6°	25.3°
CAP	CAH	CAF	H9	179.6°	180.0°
CAF	CAG	CAI	H10	180.0°	180.0°
CAF	CAG	CAI	CAQ	2.9°	0.3°
CAG	CAF	CAH	H8	179.6°	180.0°
CAF	CAG	CAI	H11	177.1°	180.0°
CAP	CAJ	CAK	H6	120.0°	120.0°
CAP	CAJ	CAK	H7	119.9°	120.0°
CAJ	CAP	CAQ	CAI	178.0°	179.7°
CAJ	CAP	CAQ	OAN	3.0°	0.0°
CAP	CAJ	CAK	CAS	69.9°	180.0°
CAP	CAJ	CAK	H4	170.5°	60.0°
CAP	CAJ	CAK	H5	49.7°	60.0°
CAP	CAJ	H6	H7	120.1°	120.0°
CAJ	CAP	CAH	H8	1.8°	0.0°
CAK	CAJ	CAP	CAQ	101.1°	85.0°
CAJ	CAK	CAS	H4	119.6°	120.0°
CAJ	CAK	CAS	H5	119.6°	120.1°
CAJ	CAK	CAS	CAU	68.9°	87.8°
CAJ	CAK	CAS	CAR	110.7°	91.8°
CAJ	CAK	H4	H5	121.2°	120.0°
CAK	CAJ	H6	H7	120.1°	120.0°
CAP	CAQ	CAI	CAG	0.0°	0.5°
CAP	CAQ	CAI	OAN	174.2°	179.8°
CAP	CAQ	OAN	CAA	176.1°	180.0°
CAQ	CAP	CAJ	H6	18.8°	35.0°
CAQ	CAP	CAJ	H7	138.9°	154.9°
CAQ	CAP	CAH	H8	177.7°	179.7°
CAP	CAQ	CAI	H11	180.0°	179.8°
CAG	CAI	CAQ	H11	180.0°	179.7°
CAG	CAI	CAQ	OAN	174.2°	179.7°
CAI	CAG	CAF	H9	176.9°	180.0°
CAI	CAQ	OAN	CAA	1.5°	0.3°
CAQ	CAI	CAG	H10	177.1°	179.8°
OAN	CAQ	CAI	H11	5.8°	0.0°
CAQ	OAN	CAA	H12	180.0°	60.0°
CAQ	OAN	CAA	H13	60.0°	180.0°
CAQ	OAN	CAA	H14	60.0°	60.0°
OAN	CAA	H12	H13	120.0°	120.0°
OAN	CAA	H12	H14	120.0°	120.0°
OAN	CAA	H13	H14	120.0°	120.0°
CAK	CAS	CAU	OAD	0.8°	0.2°
CAK	CAS	CAU	CAR	179.6°	179.6°
CAK	CAS	CAU	NAM	175.7°	180.0°
CAK	CAS	CAR	CAO	0.4°	0.2°
CAK	CAS	CAR	NAL	179.0°	180.0°
CAS	CAK	H4	H5	121.2°	120.0°
CAS	CAK	CAJ	H6	50.1°	60.0°
CAS	CAK	CAJ	H7	170.1°	60.0°
OAD	CAU	CAS	NAM	176.5°	179.9°
OAD	CAU	CAS	CAR	179.6°	179.8°
OAD	CAU	NAM	CAT	178.4°	180.0°
OAD	CAU	NAM	H2	1.6°	0.1°
CAU	CAS	CAR	CAO	179.2°	179.9°
CAU	CAS	CAR	NAL	0.6°	0.4°
CAS	CAU	NAM	CAT	4.7°	0.1°
CAS	CAU	NAM	H2	175.3°	179.8°
CAU	CAS	CAK	H4	50.7°	32.2°
CAU	CAS	CAK	H5	171.5°	152.2°
CAR	CAS	CAU	NAM	3.9°	0.4°
CAS	CAR	CAO	NAL	178.7°	179.7°
CAS	CAR	CAO	OAE	55.1°	6.3°
CAS	CAR	CAO	OAB	131.2°	173.8°
CAS	CAR	NAL	CAT	2.3°	0.2°
CAR	CAS	CAK	H4	129.7°	148.2°
CAR	CAS	CAK	H5	8.9°	28.2°
CAS	CAR	NAL	H15	177.7°	179.8°
CAU	NAM	CAT	H2	180.0°	179.9°
CAU	NAM	CAT	NAL	1.9°	0.1°
CAU	NAM	CAT	OAC	179.7°	180.0°
CAR	CAO	OAE	OAB	173.3°	179.9°
CAO	CAR	NAL	CAT	176.5°	180.0°
CAR	CAO	OAB	H1	173.5°	180.0°
CAO	CAR	NAL	H15	3.5°	0.0°
NAL	CAR	CAO	OAE	126.2°	174.0°
NAL	CAR	CAO	OAB	47.6°	5.9°
CAR	NAL	CAT	NAM	1.6°	0.0°
CAR	NAL	CAT	H15	180.0°	180.0°
CAR	NAL	CAT	OAC	176.2°	180.0°
OAE	CAO	OAB	H1	0.0°	0.1°
NAM	CAT	NAL	OAC	177.8°	179.9°
NAM	CAT	NAL	H15	178.4°	180.0°
NAL	CAT	NAM	H2	178.1°	180.0°
OAC	CAT	NAM	H2	0.3°	0.0°
OAC	CAT	NAL	H15	3.8°	0.0°
H4	CAK	CAJ	H6	69.5°	180.0°
H4	CAK	CAJ	H7	50.5°	60.0°
H5	CAK	CAJ	H6	169.7°	60.0°
H5	CAK	CAJ	H7	70.2°	NaN°
H8	CAH	CAF	H9	0.4°	0.0°
H9	CAF	CAG	H10	3.1°	0.0°
H10	CAG	CAI	H11	2.9°	0.0°
H12	CAA	H13	H14	120.0°	120.0°

Release date:	2014-03-05
Definition date:	2013-03-12
Last modified:	2014-02-28
Release status:	REL
Processing site:	PDBJ
Derived from:	3W7G