WH0

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
FAX	CAS	sing	1.35Å	1.35Å
CAV	CAU	sing	1.53Å	1.53Å
CAS	CAT	doub	1.38Å	1.38Å	Aromatic
CAS	CAE	sing	1.39Å	1.33Å	Aromatic
OAB	CAE	sing	1.35Å	1.33Å	Aromatic
OAB	CAA	sing	1.34Å	1.26Å	Aromatic
CAT	CAR	sing	1.39Å	1.38Å	Aromatic
CAE	CAD	doub	1.40Å	1.35Å	Aromatic
CAU	CAA	sing	1.51Å	1.51Å
CAA	CAC	doub	1.36Å	1.34Å	Aromatic
CAR	CAQ	doub	1.38Å	1.38Å	Aromatic
CAD	CAC	sing	1.48Å	1.34Å	Aromatic
CAD	CAQ	sing	1.39Å	1.33Å	Aromatic
CAC	CAF	sing	1.47Å	1.35Å
CAQ	FAW	sing	1.35Å	1.33Å
OAM	CAF	doub	1.22Å	1.23Å
CAF	CAG	sing	1.48Å	1.41Å
CAG	CAI	doub	1.40Å	1.40Å	Aromatic
CAG	CAH	sing	1.40Å	1.41Å	Aromatic
CAI	CAK	sing	1.38Å	1.40Å	Aromatic
CAH	CAJ	doub	1.38Å	1.41Å	Aromatic
CAK	IAP	sing	2.09Å	2.13Å
CAK	CAL	doub	1.39Å	1.40Å	Aromatic
CAJ	CAL	sing	1.39Å	1.39Å	Aromatic
CAJ	IAN	sing	2.09Å	2.15Å
CAL	OAO	sing	1.36Å	1.37Å
CAH	H1	sing	1.08Å	1.08Å
CAI	H2	sing	1.08Å	1.08Å
CAR	H3	sing	1.08Å	1.08Å
CAT	H4	sing	1.08Å	1.08Å
CAU	H5	sing	1.09Å	1.10Å
CAU	H6	sing	1.09Å	1.10Å
CAV	H7	sing	1.09Å	1.10Å
CAV	H8	sing	1.09Å	1.10Å
CAV	H9	sing	1.09Å	1.10Å
OAO	H10	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
FAX	CAS	CAT	118.3°	120.0°
FAX	CAS	CAE	121.8°	120.0°
CAV	CAU	CAA	108.5°	109.4°
CAV	CAU	H5	109.7°	109.5°
CAV	CAU	H6	109.7°	109.5°
CAU	CAV	H7	109.5°	109.5°
CAU	CAV	H8	109.5°	109.5°
CAU	CAV	H9	109.5°	109.4°
CAT	CAS	CAE	119.9°	119.9°
CAS	CAT	CAR	118.0°	120.7°
CAS	CAT	H4	121.0°	119.6°
CAS	CAE	OAB	129.6°	133.0°
CAS	CAE	CAD	122.3°	119.3°
CAE	OAB	CAA	107.8°	111.3°
OAB	CAE	CAD	108.1°	107.7°
OAB	CAA	CAU	120.9°	125.1°
OAB	CAA	CAC	111.2°	109.8°
CAT	CAR	CAQ	120.3°	120.2°
CAT	CAR	H3	119.9°	119.9°
CAR	CAT	H4	121.0°	119.7°
CAE	CAD	CAC	106.7°	105.5°
CAE	CAD	CAQ	119.8°	120.3°
CAU	CAA	CAC	127.9°	125.1°
CAA	CAU	H5	109.7°	109.5°
CAA	CAU	H6	109.7°	109.5°
CAA	CAC	CAD	106.2°	105.7°
CAA	CAC	CAF	125.0°	127.2°
CAR	CAQ	CAD	119.8°	119.7°
CAR	CAQ	FAW	117.9°	120.2°
CAQ	CAR	H3	119.9°	119.9°
CAC	CAD	CAQ	133.6°	134.3°
CAD	CAC	CAF	128.6°	127.1°
CAD	CAQ	FAW	122.3°	120.2°
CAC	CAF	OAM	118.0°	119.9°
CAC	CAF	CAG	124.3°	120.0°
OAM	CAF	CAG	117.7°	120.0°
CAF	CAG	CAI	125.1°	120.1°
CAF	CAG	CAH	115.8°	120.1°
CAI	CAG	CAH	119.1°	119.8°
CAG	CAI	CAK	119.7°	119.9°
CAG	CAI	H2	120.1°	120.0°
CAG	CAH	CAJ	122.4°	120.0°
CAG	CAH	H1	118.8°	120.0°
CAI	CAK	IAP	121.3°	120.0°
CAI	CAK	CAL	119.4°	120.1°
CAK	CAI	H2	120.1°	120.1°
CAH	CAJ	CAL	116.3°	120.1°
CAH	CAJ	IAN	122.1°	120.0°
CAJ	CAH	H1	118.8°	120.0°
IAP	CAK	CAL	119.3°	119.9°
CAK	CAL	CAJ	123.1°	120.1°
CAK	CAL	OAO	118.2°	119.9°
CAL	CAJ	IAN	121.6°	120.0°
CAJ	CAL	OAO	118.8°	119.9°
CAL	OAO	H10	109.5°	114.0°
H5	CAU	H6	109.5°	109.5°
H7	CAV	H8	109.5°	109.5°
H7	CAV	H9	109.4°	109.5°
H8	CAV	H9	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
FAX	CAS	CAT	CAE	179.5°	180.0°
FAX	CAS	CAE	OAB	0.5°	0.3°
FAX	CAS	CAT	CAR	179.2°	179.9°
FAX	CAS	CAE	CAD	180.0°	180.0°
FAX	CAS	CAT	H4	0.8°	0.0°
CAV	CAU	CAA	OAB	44.1°	89.7°
CAV	CAU	CAA	H5	119.8°	120.0°
CAV	CAU	CAA	H6	119.9°	120.0°
CAV	CAU	CAA	CAC	137.5°	90.0°
CAV	CAU	H5	H6	120.5°	120.0°
CAU	CAV	H7	H8	120.0°	120.0°
CAU	CAV	H7	H9	120.0°	120.0°
CAU	CAV	H8	H9	120.0°	120.0°
CAT	CAS	CAE	OAB	180.0°	179.7°
CAS	CAT	CAR	H4	180.0°	179.9°
CAT	CAS	CAE	CAD	0.5°	0.0°
CAS	CAT	CAR	CAQ	1.9°	0.1°
CAS	CAT	CAR	H3	178.1°	180.0°
CAS	CAE	OAB	CAD	179.6°	179.7°
CAS	CAE	OAB	CAA	179.7°	179.9°
CAE	CAS	CAT	CAR	1.3°	0.1°
CAS	CAE	CAD	CAC	178.8°	180.0°
CAS	CAE	CAD	CAQ	0.3°	0.0°
CAE	CAS	CAT	H4	178.7°	180.0°
CAE	OAB	CAA	CAU	179.9°	179.9°
CAE	OAB	CAA	CAC	1.3°	0.4°
OAB	CAE	CAD	CAC	1.6°	0.2°
OAB	CAE	CAD	CAQ	179.9°	179.8°
CAA	OAB	CAE	CAD	0.2°	0.4°
OAB	CAA	CAU	CAC	178.3°	179.7°
OAB	CAA	CAC	CAD	2.3°	0.2°
OAB	CAA	CAC	CAF	177.0°	179.8°
OAB	CAA	CAU	H5	75.7°	30.3°
OAB	CAA	CAU	H6	164.0°	150.3°
CAT	CAR	CAQ	H3	180.0°	179.8°
CAT	CAR	CAQ	CAD	1.7°	0.1°
CAT	CAR	CAQ	FAW	178.7°	179.9°
CAE	CAD	CAC	CAA	2.3°	0.0°
CAE	CAD	CAQ	CAR	0.8°	0.0°
CAE	CAD	CAC	CAQ	178.3°	180.0°
CAE	CAD	CAC	CAF	176.7°	180.0°
CAE	CAD	CAQ	FAW	179.6°	180.0°
CAU	CAA	CAC	CAD	179.2°	180.0°
CAU	CAA	CAC	CAF	4.5°	0.0°
CAA	CAU	H5	H6	120.5°	120.1°
CAA	CAU	CAV	H7	180.0°	60.0°
CAA	CAU	CAV	H8	60.0°	60.0°
CAA	CAU	CAV	H9	60.0°	180.0°
CAA	CAC	CAD	CAF	174.4°	180.0°
CAA	CAC	CAD	CAQ	179.4°	180.0°
CAA	CAC	CAF	OAM	59.4°	94.7°
CAA	CAC	CAF	CAG	123.5°	85.3°
CAC	CAA	CAU	H5	102.6°	150.0°
CAC	CAA	CAU	H6	17.7°	30.0°
CAR	CAQ	CAD	CAC	179.0°	179.9°
CAR	CAQ	CAD	FAW	179.6°	180.0°
CAQ	CAR	CAT	H4	178.1°	180.0°
CAC	CAD	CAQ	FAW	1.4°	0.0°
CAD	CAC	CAF	OAM	114.1°	85.3°
CAD	CAC	CAF	CAG	63.0°	94.7°
CAQ	CAD	CAC	CAF	5.0°	0.0°
CAD	CAQ	CAR	H3	178.3°	179.9°
CAC	CAF	OAM	CAG	177.3°	180.0°
CAC	CAF	CAG	CAI	5.8°	174.6°
CAC	CAF	CAG	CAH	174.3°	5.7°
FAW	CAQ	CAR	H3	1.3°	0.1°
OAM	CAF	CAG	CAI	177.1°	5.5°
OAM	CAF	CAG	CAH	2.8°	174.3°
CAF	CAG	CAI	CAH	179.9°	179.8°
CAF	CAG	CAI	CAK	179.9°	180.0°
CAF	CAG	CAH	CAJ	179.9°	180.0°
CAF	CAG	CAH	H1	0.0°	0.0°
CAF	CAG	CAI	H2	0.1°	0.1°
CAG	CAI	CAK	H2	180.0°	179.9°
CAI	CAG	CAH	CAJ	0.1°	0.2°
CAG	CAI	CAK	IAP	179.8°	180.0°
CAG	CAI	CAK	CAL	0.3°	0.1°
CAI	CAG	CAH	H1	179.9°	179.8°
CAH	CAG	CAI	CAK	0.0°	0.2°
CAG	CAH	CAJ	H1	180.0°	180.0°
CAG	CAH	CAJ	CAL	0.1°	0.0°
CAG	CAH	CAJ	IAN	179.6°	180.0°
CAH	CAG	CAI	H2	180.0°	179.7°
CAI	CAK	IAP	CAL	179.5°	180.0°
CAI	CAK	CAL	CAJ	0.6°	0.3°
CAI	CAK	CAL	OAO	179.9°	180.0°
CAH	CAJ	CAL	CAK	0.5°	0.3°
CAH	CAJ	CAL	IAN	179.5°	180.0°
CAH	CAJ	CAL	OAO	179.9°	180.0°
IAP	CAK	CAL	CAJ	179.9°	179.7°
IAP	CAK	CAL	OAO	0.4°	0.0°
IAP	CAK	CAI	H2	0.2°	0.1°
CAK	CAL	CAJ	OAO	179.5°	179.7°
CAK	CAL	CAJ	IAN	179.9°	179.7°
CAL	CAK	CAI	H2	179.6°	180.0°
CAK	CAL	OAO	H10	180.0°	89.7°
CAL	CAJ	CAH	H1	179.9°	180.0°
CAJ	CAL	OAO	H10	0.5°	90.0°
IAN	CAJ	CAL	OAO	0.6°	0.0°
IAN	CAJ	CAH	H1	0.4°	0.0°
H3	CAR	CAT	H4	1.9°	0.1°
H5	CAU	CAV	H7	60.2°	180.0°
H5	CAU	CAV	H8	59.9°	60.0°
H5	CAU	CAV	H9	179.9°	60.0°
H6	CAU	CAV	H7	60.1°	60.1°
H6	CAU	CAV	H8	179.9°	180.0°
H6	CAU	CAV	H9	59.8°	60.0°
H7	CAV	H8	H9	120.0°	120.0°

Release date:	2024-05-15
Definition date:	2023-10-03
Last modified:	2024-05-10
Release status:	REL
Processing site:	PDBJ
Derived from:	8WGU