Y03

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
OAU	PAR	doub	1.48Å	1.56Å
CL1	CAG	sing	1.74Å	1.63Å
OAK	CAA	sing	1.43Å	1.44Å
OAK	CAL	sing	1.36Å	1.37Å
CAA	CAB	sing	1.51Å	1.54Å
CAQ	CAL	doub	1.39Å	1.40Å	Aromatic
CAQ	CAP	sing	1.38Å	1.40Å	Aromatic
CAF	CAG	doub	1.38Å	1.39Å	Aromatic
CAF	CAE	sing	1.39Å	1.38Å	Aromatic
CAL	CAM	sing	1.39Å	1.37Å	Aromatic
CAB	OAD	doub	1.21Å	1.23Å
CAB	NAC	sing	1.35Å	1.34Å
CAP	CAO	doub	1.38Å	1.41Å	Aromatic
CAM	PAR	sing	1.81Å	1.86Å
CAM	CAN	doub	1.38Å	1.40Å	Aromatic
PAR	OAS	sing	1.61Å	1.60Å
PAR	OAT	sing	1.61Å	1.51Å
CAG	CAH	sing	1.38Å	1.38Å	Aromatic
NAC	CAE	sing	1.40Å	1.34Å
CAO	CAN	sing	1.38Å	1.40Å	Aromatic
CAE	CAJ	doub	1.39Å	1.40Å	Aromatic
CAH	CAI	doub	1.38Å	1.38Å	Aromatic
CAJ	CAI	sing	1.38Å	1.40Å	Aromatic
CAI	CL2	sing	1.74Å	1.71Å
OAS	H1	sing	0.97Å	0.95Å
OAT	H2	sing	0.97Å	0.95Å
CAN	H3	sing	1.08Å	1.08Å
CAO	H4	sing	1.08Å	1.08Å
CAP	H5	sing	1.08Å	1.08Å
CAQ	H6	sing	1.08Å	1.08Å
CAA	H7	sing	1.09Å	1.10Å
CAA	H8	sing	1.09Å	1.10Å
NAC	H9	sing	0.97Å	1.00Å
CAF	H10	sing	1.08Å	1.08Å
CAH	H11	sing	1.08Å	1.08Å
CAJ	H12	sing	1.08Å	1.08Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
OAU	PAR	CAM	105.9°	109.5°
OAU	PAR	OAS	118.1°	109.5°
OAU	PAR	OAT	106.9°	109.4°
CL1	CAG	CAF	117.9°	120.0°
CL1	CAG	CAH	119.8°	120.0°
CAA	OAK	CAL	120.6°	117.1°
OAK	CAA	CAB	107.2°	109.5°
OAK	CAA	H7	110.0°	109.4°
OAK	CAA	H8	110.0°	109.4°
OAK	CAL	CAQ	123.3°	120.0°
OAK	CAL	CAM	115.0°	120.1°
CAA	CAB	OAD	120.4°	120.0°
CAA	CAB	NAC	114.7°	120.0°
CAB	CAA	H7	110.0°	109.5°
CAB	CAA	H8	110.1°	109.5°
CAL	CAQ	CAP	120.0°	119.9°
CAQ	CAL	CAM	121.7°	119.9°
CAL	CAQ	H6	120.0°	120.0°
CAQ	CAP	CAO	118.0°	120.1°
CAQ	CAP	H5	121.0°	119.9°
CAP	CAQ	H6	120.0°	120.1°
CAG	CAF	CAE	118.9°	119.9°
CAF	CAG	CAH	122.3°	120.1°
CAG	CAF	H10	120.6°	120.0°
CAF	CAE	NAC	120.4°	120.0°
CAF	CAE	CAJ	119.5°	119.9°
CAE	CAF	H10	120.5°	120.1°
CAL	CAM	PAR	119.2°	120.0°
CAL	CAM	CAN	119.3°	120.0°
OAD	CAB	NAC	124.9°	120.0°
CAB	NAC	CAE	121.2°	120.0°
CAB	NAC	H9	119.4°	119.9°
CAP	CAO	CAN	121.4°	120.1°
CAP	CAO	H4	119.3°	119.9°
CAO	CAP	H5	121.0°	120.0°
PAR	CAM	CAN	121.5°	120.0°
CAM	PAR	OAS	108.7°	109.4°
CAM	PAR	OAT	113.1°	109.5°
CAM	CAN	CAO	119.6°	120.0°
CAM	CAN	H3	120.2°	120.0°
OAS	PAR	OAT	104.5°	109.5°
PAR	OAS	H1	109.5°	114.0°
PAR	OAT	H2	109.5°	114.0°
CAG	CAH	CAI	118.9°	120.1°
CAG	CAH	H11	120.6°	119.9°
NAC	CAE	CAJ	120.0°	120.1°
CAE	NAC	H9	119.4°	120.1°
CAO	CAN	H3	120.2°	120.0°
CAN	CAO	H4	119.3°	119.9°
CAE	CAJ	CAI	120.4°	119.9°
CAE	CAJ	H12	119.8°	120.0°
CAH	CAI	CAJ	120.0°	120.1°
CAH	CAI	CL2	118.5°	119.9°
CAI	CAH	H11	120.6°	120.0°
CAJ	CAI	CL2	121.5°	120.0°
CAI	CAJ	H12	119.8°	120.1°
H7	CAA	H8	109.5°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
OAU	PAR	CAM	CAL	62.6°	149.7°
OAU	PAR	CAM	OAS	127.8°	120.0°
OAU	PAR	CAM	OAT	116.7°	120.0°
OAU	PAR	CAM	CAN	117.6°	30.0°
OAU	PAR	OAS	OAT	118.5°	120.0°
OAU	PAR	OAS	H1	0.0°	180.0°
OAU	PAR	OAT	H2	0.0°	60.1°
CL1	CAG	CAF	CAH	178.6°	180.0°
CL1	CAG	CAF	CAE	178.8°	180.0°
CL1	CAG	CAH	CAI	179.1°	180.0°
CL1	CAG	CAF	H10	1.2°	0.0°
CL1	CAG	CAH	H11	0.9°	0.0°
OAK	CAA	CAB	H7	119.6°	120.0°
OAK	CAA	CAB	H8	119.6°	120.0°
CAA	OAK	CAL	CAQ	23.2°	0.1°
CAA	OAK	CAL	CAM	157.8°	179.4°
OAK	CAA	CAB	OAD	170.9°	0.0°
OAK	CAA	CAB	NAC	8.7°	180.0°
OAK	CAA	H7	H8	121.0°	119.9°
CAL	OAK	CAA	CAB	150.6°	179.9°
OAK	CAL	CAQ	CAM	178.9°	179.5°
OAK	CAL	CAQ	CAP	179.5°	180.0°
OAK	CAL	CAM	PAR	1.2°	0.3°
OAK	CAL	CAM	CAN	178.9°	180.0°
OAK	CAL	CAQ	H6	0.5°	0.5°
CAL	OAK	CAA	H7	89.7°	59.9°
CAL	OAK	CAA	H8	31.0°	60.0°
CAA	CAB	OAD	NAC	179.6°	180.0°
CAA	CAB	NAC	CAE	176.3°	175.3°
CAB	CAA	H7	H8	121.1°	120.1°
CAA	CAB	NAC	H9	3.7°	4.6°
CAL	CAQ	CAP	H6	180.0°	179.5°
CAL	CAQ	CAP	CAO	0.2°	0.3°
CAQ	CAL	CAM	PAR	179.7°	179.8°
CAQ	CAL	CAM	CAN	0.1°	0.6°
CAL	CAQ	CAP	H5	179.8°	179.7°
CAP	CAQ	CAL	CAM	0.5°	0.5°
CAQ	CAP	CAO	H5	180.0°	180.0°
CAQ	CAP	CAO	CAN	0.7°	0.0°
CAQ	CAP	CAO	H4	179.2°	180.0°
CAG	CAF	CAE	H10	180.0°	180.0°
CAG	CAF	CAE	NAC	178.7°	180.0°
CAG	CAF	CAE	CAJ	0.5°	0.3°
CAF	CAG	CAH	CAI	0.5°	0.0°
CAF	CAG	CAH	H11	179.4°	180.0°
CAF	CAE	NAC	CAB	82.5°	144.6°
CAE	CAF	CAG	CAH	0.3°	0.0°
CAF	CAE	NAC	CAJ	178.2°	179.8°
CAF	CAE	CAJ	CAI	1.0°	0.5°
CAF	CAE	NAC	H9	97.4°	35.3°
CAF	CAE	CAJ	H12	178.9°	179.7°
CAL	CAM	PAR	CAN	179.9°	179.7°
CAL	CAM	PAR	OAS	169.7°	90.3°
CAL	CAM	PAR	OAT	54.1°	29.7°
CAL	CAM	CAN	CAO	1.1°	0.3°
CAL	CAM	CAN	H3	178.9°	179.7°
CAM	CAL	CAQ	H6	179.5°	180.0°
OAD	CAB	NAC	CAE	4.1°	4.6°
OAD	CAB	CAA	H7	51.3°	120.0°
OAD	CAB	CAA	H8	69.4°	120.0°
OAD	CAB	NAC	H9	175.9°	175.4°
CAB	NAC	CAE	H9	180.0°	180.0°
CAB	NAC	CAE	CAJ	99.3°	35.1°
NAC	CAB	CAA	H7	128.3°	60.0°
NAC	CAB	CAA	H8	111.0°	60.0°
CAP	CAO	CAN	CAM	1.4°	0.0°
CAP	CAO	CAN	H4	180.0°	180.0°
CAP	CAO	CAN	H3	178.6°	180.0°
CAO	CAP	CAQ	H6	179.8°	179.8°
CAM	PAR	OAS	OAT	121.0°	120.0°
PAR	CAM	CAN	CAO	178.8°	180.0°
CAM	PAR	OAS	H1	120.5°	60.1°
CAM	PAR	OAT	H2	116.1°	179.9°
PAR	CAM	CAN	H3	1.2°	0.0°
CAN	CAM	PAR	OAS	10.2°	90.0°
CAN	CAM	PAR	OAT	125.8°	149.9°
CAM	CAN	CAO	H3	180.0°	180.0°
CAM	CAN	CAO	H4	178.6°	180.0°
OAS	PAR	OAT	H2	125.9°	59.9°
OAT	PAR	OAS	H1	118.5°	60.0°
CAG	CAH	CAI	H11	180.0°	180.0°
CAG	CAH	CAI	CAJ	0.0°	0.2°
CAG	CAH	CAI	CL2	179.9°	180.0°
CAH	CAG	CAF	H10	179.8°	180.0°
NAC	CAE	CAJ	CAI	179.2°	179.7°
NAC	CAE	CAF	H10	1.3°	0.0°
NAC	CAE	CAJ	H12	0.7°	0.1°
CAN	CAO	CAP	H5	179.2°	180.0°
CAE	CAJ	CAI	CAH	0.8°	0.5°
CAE	CAJ	CAI	H12	180.0°	179.8°
CAE	CAJ	CAI	CL2	179.1°	179.7°
CAJ	CAE	NAC	H9	80.7°	144.9°
CAJ	CAE	CAF	H10	179.5°	179.8°
CAH	CAI	CAJ	CL2	179.9°	179.8°
CAH	CAI	CAJ	H12	179.2°	179.7°
CAJ	CAI	CAH	H11	180.0°	179.8°
CL2	CAI	CAH	H11	0.1°	0.0°
CL2	CAI	CAJ	H12	1.0°	0.1°
H3	CAN	CAO	H4	1.4°	0.0°
H4	CAO	CAP	H5	0.8°	0.0°
H5	CAP	CAQ	H6	0.2°	0.2°

Release date:	2013-07-31
Definition date:	2012-02-02
Last modified:	2013-07-26
Release status:	REL
Processing site:	RCSB
Derived from:	4DHS