2LW

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAE	CAO	doub	1.39Å	1.35Å	Aromatic
CAE	CAD	sing	1.38Å	1.40Å	Aromatic
NAJ	CAO	sing	1.36Å	1.34Å	Aromatic
NAJ	CAM	sing	1.37Å	1.34Å	Aromatic
CAO	CAP	sing	1.42Å	1.38Å	Aromatic
CAG	CAM	sing	1.51Å	1.46Å
CAG	CAH	sing	1.53Å	1.54Å
CAD	CAL	doub	1.39Å	1.41Å	Aromatic
CAM	CAN	doub	1.35Å	1.40Å	Aromatic
OAB	CAK	doub	1.21Å	1.22Å
CAK	CAA	sing	1.51Å	1.58Å
CAK	NAQ	sing	1.35Å	1.29Å
CAP	CAN	sing	1.45Å	1.37Å	Aromatic
CAP	CAF	doub	1.40Å	1.34Å	Aromatic
CAL	CAF	sing	1.38Å	1.41Å	Aromatic
CAL	CL	sing	1.74Å	1.72Å
CAN	CAI	sing	1.51Å	1.40Å
NAQ	CAH	sing	1.47Å	1.44Å
NAQ	CAI	sing	1.47Å	1.55Å
CAH	H1	sing	1.09Å	1.10Å
CAH	H2	sing	1.09Å	1.10Å
CAG	H3	sing	1.09Å	1.10Å
CAG	H4	sing	1.09Å	1.10Å
NAJ	H5	sing	0.97Å	1.00Å
CAE	H6	sing	1.08Å	1.08Å
CAD	H7	sing	1.08Å	1.08Å
CAF	H8	sing	1.08Å	1.08Å
CAI	H9	sing	1.09Å	1.10Å
CAI	H10	sing	1.09Å	1.10Å
CAA	H11	sing	1.09Å	1.10Å
CAA	H12	sing	1.09Å	1.10Å
CAA	H13	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAO	CAE	CAD	120.0°	117.1°
CAE	CAO	NAJ	129.0°	132.1°
CAE	CAO	CAP	122.7°	120.6°
CAO	CAE	H6	120.0°	121.5°
CAE	CAD	CAL	118.0°	122.2°
CAD	CAE	H6	120.0°	121.4°
CAE	CAD	H7	121.0°	118.9°
CAO	NAJ	CAM	111.0°	109.9°
NAJ	CAO	CAP	108.3°	107.3°
CAO	NAJ	H5	124.5°	125.1°
NAJ	CAM	CAG	126.9°	126.3°
NAJ	CAM	CAN	105.6°	109.6°
CAM	NAJ	H5	124.5°	125.1°
CAO	CAP	CAN	106.5°	105.9°
CAO	CAP	CAF	118.7°	121.3°
CAM	CAG	CAH	110.1°	109.0°
CAG	CAM	CAN	127.5°	124.1°
CAM	CAG	H3	109.3°	109.6°
CAM	CAG	H4	109.3°	109.5°
CAG	CAH	NAQ	106.6°	109.2°
CAG	CAH	H1	110.2°	109.6°
CAG	CAH	H2	110.2°	109.6°
CAH	CAG	H3	109.3°	109.6°
CAH	CAG	H4	109.3°	109.5°
CAD	CAL	CAF	119.2°	121.9°
CAD	CAL	CL	117.7°	119.1°
CAL	CAD	H7	121.0°	118.8°
CAM	CAN	CAP	108.7°	107.3°
CAM	CAN	CAI	120.1°	124.2°
OAB	CAK	CAA	118.0°	120.0°
OAB	CAK	NAQ	127.2°	120.0°
CAA	CAK	NAQ	112.1°	120.0°
CAK	CAA	H11	109.5°	109.5°
CAK	CAA	H12	109.5°	109.5°
CAK	CAA	H13	109.5°	109.5°
CAK	NAQ	CAH	117.6°	121.0°
CAK	NAQ	CAI	124.6°	120.9°
CAN	CAP	CAF	134.7°	132.8°
CAP	CAN	CAI	131.2°	128.5°
CAP	CAF	CAL	121.4°	116.8°
CAP	CAF	H8	119.3°	121.6°
CAF	CAL	CL	123.1°	119.0°
CAL	CAF	H8	119.3°	121.7°
CAN	CAI	NAQ	109.8°	107.4°
CAN	CAI	H9	109.4°	109.9°
CAN	CAI	H10	109.4°	109.9°
CAH	NAQ	CAI	117.5°	118.1°
NAQ	CAH	H1	110.2°	109.5°
NAQ	CAH	H2	110.2°	109.5°
NAQ	CAI	H9	109.4°	109.8°
NAQ	CAI	H10	109.4°	109.9°
H1	CAH	H2	109.4°	109.5°
H3	CAG	H4	109.5°	109.6°
H9	CAI	H10	109.5°	109.9°
H11	CAA	H12	109.4°	109.5°
H11	CAA	H13	109.5°	109.5°
H12	CAA	H13	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CAO	CAE	CAD	H6	180.0°	179.9°
CAE	CAO	NAJ	CAP	179.6°	180.0°
CAE	CAO	NAJ	CAM	179.9°	179.9°
CAO	CAE	CAD	CAL	0.2°	0.1°
CAE	CAO	CAP	CAN	179.5°	180.0°
CAE	CAO	CAP	CAF	0.5°	0.0°
CAE	CAO	NAJ	H5	0.1°	0.1°
CAO	CAE	CAD	H7	179.9°	180.0°
CAD	CAE	CAO	NAJ	179.3°	180.0°
CAD	CAE	CAO	CAP	0.3°	0.0°
CAE	CAD	CAL	H7	180.0°	179.9°
CAE	CAD	CAL	CAF	0.8°	0.1°
CAE	CAD	CAL	CL	179.5°	180.0°
CAO	NAJ	CAM	H5	180.0°	180.0°
CAO	NAJ	CAM	CAG	179.0°	179.8°
CAO	NAJ	CAM	CAN	0.6°	0.2°
NAJ	CAO	CAP	CAN	0.2°	0.0°
NAJ	CAO	CAP	CAF	179.8°	180.0°
NAJ	CAO	CAE	H6	0.7°	0.1°
CAM	NAJ	CAO	CAP	0.3°	0.1°
NAJ	CAM	CAG	CAN	179.5°	180.0°
NAJ	CAM	CAG	CAH	165.2°	161.9°
NAJ	CAM	CAN	CAP	0.6°	0.1°
NAJ	CAM	CAN	CAI	178.6°	179.7°
NAJ	CAM	CAG	H3	45.1°	42.0°
NAJ	CAM	CAG	H4	74.7°	78.3°
CAO	CAP	CAN	CAM	0.5°	0.1°
CAO	CAP	CAN	CAF	180.0°	180.0°
CAO	CAP	CAF	CAL	1.5°	0.0°
CAO	CAP	CAN	CAI	178.2°	179.7°
CAP	CAO	NAJ	H5	179.7°	179.9°
CAP	CAO	CAE	H6	179.7°	179.9°
CAO	CAP	CAF	H8	178.5°	180.0°
CAM	CAG	CAH	H3	120.1°	119.9°
CAM	CAG	CAH	H4	120.1°	119.8°
CAG	CAM	CAN	CAP	178.9°	179.8°
CAG	CAM	CAN	CAI	1.0°	0.4°
CAM	CAG	CAH	NAQ	43.6°	45.6°
CAM	CAG	CAH	H1	75.9°	165.6°
CAM	CAG	CAH	H2	163.2°	74.3°
CAM	CAG	H3	H4	119.8°	120.2°
CAG	CAM	NAJ	H5	1.0°	0.2°
CAH	CAG	CAM	CAN	15.3°	18.2°
CAG	CAH	NAQ	CAK	110.5°	115.6°
CAG	CAH	NAQ	H1	119.6°	120.0°
CAG	CAH	NAQ	H2	119.6°	120.0°
CAG	CAH	NAQ	CAI	63.5°	64.2°
CAG	CAH	H1	H2	121.4°	120.2°
CAH	CAG	H3	H4	119.7°	120.2°
CAD	CAL	CAF	CAP	1.7°	0.1°
CAD	CAL	CAF	CL	179.7°	179.9°
CAL	CAD	CAE	H6	179.9°	180.0°
CAD	CAL	CAF	H8	178.3°	179.9°
CAM	CAN	CAP	CAI	177.6°	179.8°
CAM	CAN	CAP	CAF	179.5°	179.9°
CAM	CAN	CAI	NAQ	12.1°	10.9°
CAN	CAM	CAG	H3	135.4°	138.0°
CAN	CAM	CAG	H4	104.7°	101.7°
CAN	CAM	NAJ	H5	179.4°	179.8°
CAM	CAN	CAI	H9	132.2°	108.5°
CAM	CAN	CAI	H10	107.9°	130.5°
OAB	CAK	CAA	NAQ	162.6°	179.9°
OAB	CAK	NAQ	CAH	14.4°	180.0°
OAB	CAK	NAQ	CAI	172.0°	0.2°
OAB	CAK	CAA	H11	0.0°	120.0°
OAB	CAK	CAA	H12	120.0°	0.0°
OAB	CAK	CAA	H13	120.0°	120.0°
CAA	CAK	NAQ	CAH	175.1°	0.1°
CAA	CAK	NAQ	CAI	11.3°	179.9°
CAK	CAA	H11	H12	120.0°	120.0°
CAK	CAA	H11	H13	120.0°	120.0°
CAK	CAA	H12	H13	120.0°	120.0°
CAK	NAQ	CAI	CAN	126.3°	136.0°
CAK	NAQ	CAH	CAI	174.1°	179.8°
CAK	NAQ	CAH	H1	129.9°	4.3°
CAK	NAQ	CAH	H2	9.1°	124.4°
CAK	NAQ	CAI	H9	6.2°	104.5°
CAK	NAQ	CAI	H10	113.7°	16.5°
NAQ	CAK	CAA	H11	162.6°	60.0°
NAQ	CAK	CAA	H12	77.4°	180.0°
NAQ	CAK	CAA	H13	42.6°	60.0°
CAN	CAP	CAF	CAL	178.5°	180.0°
CAP	CAN	CAI	NAQ	165.3°	169.3°
CAN	CAP	CAF	H8	1.5°	0.0°
CAP	CAN	CAI	H9	45.3°	71.3°
CAP	CAN	CAI	H10	74.6°	49.7°
CAP	CAF	CAL	H8	180.0°	180.0°
CAP	CAF	CAL	CL	178.6°	180.0°
CAF	CAP	CAN	CAI	1.8°	0.3°
CAF	CAL	CAD	H7	179.2°	180.0°
CL	CAL	CAD	H7	0.5°	0.1°
CL	CAL	CAF	H8	1.4°	0.0°
CAN	CAI	NAQ	CAH	47.4°	43.8°
CAN	CAI	NAQ	H9	120.1°	119.5°
CAN	CAI	NAQ	H10	120.0°	119.6°
CAN	CAI	H9	H10	119.9°	121.0°
NAQ	CAH	H1	H2	121.3°	120.0°
NAQ	CAH	CAG	H3	163.8°	165.5°
NAQ	CAH	CAG	H4	76.5°	74.2°
CAH	NAQ	CAI	H9	167.4°	75.7°
CAH	NAQ	CAI	H10	72.7°	163.3°
CAI	NAQ	CAH	H1	56.0°	175.8°
CAI	NAQ	CAH	H2	176.9°	55.8°
NAQ	CAI	H9	H10	119.9°	121.0°
H1	CAH	CAG	H3	44.2°	74.5°
H1	CAH	CAG	H4	164.0°	45.7°
H2	CAH	CAG	H3	76.7°	45.6°
H2	CAH	CAG	H4	43.1°	165.9°
H6	CAE	CAD	H7	0.1°	0.2°
H11	CAA	H12	H13	120.0°	120.0°

Release date:	2013-12-25
Definition date:	2013-11-29
Last modified:	2013-12-20
Release status:	REL
Processing site:	RCSB
Derived from:	4NRA