A1ADG

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAL	CAM	doub	1.38Å	1.39Å	Aromatic
CAL	CAK	sing	1.40Å	1.39Å	Aromatic
CAM	CAN	sing	1.39Å	1.39Å	Aromatic
NAJ	CAK	sing	1.36Å	1.34Å
NAJ	CAI	doub	1.30Å	1.34Å
CAK	CAP	doub	1.41Å	1.38Å	Aromatic
CAN	CAO	doub	1.38Å	1.39Å	Aromatic
CAS	CAI	sing	1.51Å	1.39Å
CAI	NAH	sing	1.36Å	1.35Å
CAP	CAO	sing	1.39Å	1.39Å	Aromatic
CAP	CAQ	sing	1.47Å	1.38Å
CAA	CAB	sing	1.51Å	1.39Å
NAH	CAQ	sing	1.35Å	1.34Å
NAH	CAG	sing	1.40Å	1.34Å
CAQ	OAR	doub	1.22Å	1.23Å
CAB	CAG	doub	1.39Å	1.39Å	Aromatic
CAB	CAC	sing	1.38Å	1.39Å	Aromatic
CAG	CAF	sing	1.39Å	1.39Å	Aromatic
CAC	CAD	doub	1.38Å	1.39Å	Aromatic
CAF	CAE	doub	1.38Å	1.39Å	Aromatic
CAD	CAE	sing	1.38Å	1.39Å	Aromatic
CAA	H1	sing	1.09Å	1.10Å
CAA	H2	sing	1.09Å	1.10Å
CAA	H3	sing	1.09Å	1.10Å
CAC	H4	sing	1.08Å	1.08Å
CAD	H5	sing	1.08Å	1.08Å
CAE	H6	sing	1.08Å	1.08Å
CAF	H7	sing	1.08Å	1.08Å
CAL	H8	sing	1.08Å	1.08Å
CAM	H9	sing	1.08Å	1.08Å
CAN	H10	sing	1.08Å	1.08Å
CAO	H11	sing	1.08Å	1.08Å
CAS	H12	sing	1.09Å	1.10Å
CAS	H13	sing	1.09Å	1.10Å
CAS	H14	sing	1.09Å	1.10Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAM	CAL	CAK	119.9°	119.7°
CAL	CAM	CAN	120.0°	120.8°
CAM	CAL	H8	120.0°	120.1°
CAL	CAM	H9	120.0°	119.6°
CAL	CAK	NAJ	120.7°	121.6°
CAL	CAK	CAP	119.9°	119.3°
CAK	CAL	H8	120.1°	120.2°
CAM	CAN	CAO	119.9°	120.6°
CAN	CAM	H9	120.0°	119.6°
CAM	CAN	H10	120.0°	119.7°
CAK	NAJ	CAI	120.8°	121.6°
NAJ	CAK	CAP	119.4°	119.0°
NAJ	CAI	CAS	118.5°	118.4°
NAJ	CAI	NAH	120.6°	123.4°
CAK	CAP	CAO	120.4°	120.1°
CAK	CAP	CAQ	119.0°	118.1°
CAN	CAO	CAP	119.8°	119.5°
CAO	CAN	H10	120.0°	119.7°
CAN	CAO	H11	120.1°	120.3°
CAS	CAI	NAH	120.9°	118.3°
CAI	CAS	H12	109.5°	109.5°
CAI	CAS	H13	109.5°	109.4°
CAI	CAS	H14	109.4°	109.5°
CAI	NAH	CAQ	120.7°	120.6°
CAI	NAH	CAG	120.9°	119.8°
CAO	CAP	CAQ	120.6°	121.9°
CAP	CAO	H11	120.1°	120.2°
CAP	CAQ	NAH	119.4°	117.4°
CAP	CAQ	OAR	120.9°	121.3°
CAA	CAB	CAG	120.6°	120.0°
CAA	CAB	CAC	119.7°	120.1°
CAB	CAA	H1	109.5°	109.5°
CAB	CAA	H2	109.5°	109.5°
CAB	CAA	H3	109.5°	109.5°
CAQ	NAH	CAG	118.3°	119.7°
NAH	CAQ	OAR	119.7°	121.3°
NAH	CAG	CAB	120.3°	120.1°
NAH	CAG	CAF	119.6°	120.0°
CAG	CAB	CAC	119.7°	119.9°
CAB	CAG	CAF	120.1°	119.9°
CAB	CAC	CAD	120.2°	120.1°
CAB	CAC	H4	119.9°	119.9°
CAG	CAF	CAE	120.0°	119.9°
CAG	CAF	H7	120.0°	120.0°
CAC	CAD	CAE	119.9°	120.1°
CAD	CAC	H4	119.9°	120.0°
CAC	CAD	H5	120.0°	119.9°
CAF	CAE	CAD	120.0°	120.0°
CAF	CAE	H6	120.0°	120.0°
CAE	CAF	H7	120.0°	120.0°
CAE	CAD	H5	120.0°	119.9°
CAD	CAE	H6	120.0°	120.0°
H1	CAA	H2	109.4°	109.5°
H1	CAA	H3	109.5°	109.4°
H2	CAA	H3	109.5°	109.5°
H12	CAS	H13	109.5°	109.5°
H12	CAS	H14	109.5°	109.5°
H13	CAS	H14	109.5°	109.5°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CAM	CAL	CAK	H8	180.0°	180.0°
CAL	CAM	CAN	H9	180.0°	179.9°
CAM	CAL	CAK	NAJ	180.0°	179.8°
CAM	CAL	CAK	CAP	0.1°	0.0°
CAL	CAM	CAN	CAO	0.1°	0.0°
CAL	CAM	CAN	H10	179.9°	179.9°
CAK	CAL	CAM	CAN	0.0°	0.0°
CAL	CAK	NAJ	CAP	179.9°	179.8°
CAL	CAK	NAJ	CAI	179.9°	179.7°
CAL	CAK	CAP	CAO	0.1°	0.0°
CAL	CAK	CAP	CAQ	179.9°	180.0°
CAK	CAL	CAM	H9	180.0°	180.0°
CAM	CAN	CAO	H10	180.0°	179.9°
CAM	CAN	CAO	CAP	0.0°	0.0°
CAN	CAM	CAL	H8	180.0°	180.0°
CAM	CAN	CAO	H11	180.0°	179.9°
CAK	NAJ	CAI	CAS	179.8°	179.7°
CAK	NAJ	CAI	NAH	0.1°	0.0°
NAJ	CAK	CAP	CAO	180.0°	179.8°
NAJ	CAK	CAP	CAQ	0.2°	0.2°
NAJ	CAK	CAL	H8	0.0°	0.2°
CAI	NAJ	CAK	CAP	0.0°	0.1°
NAJ	CAI	CAS	NAH	179.7°	179.7°
NAJ	CAI	NAH	CAQ	0.1°	0.3°
NAJ	CAI	NAH	CAG	180.0°	179.8°
NAJ	CAI	CAS	H12	0.0°	90.2°
NAJ	CAI	CAS	H13	120.0°	29.7°
NAJ	CAI	CAS	H14	120.0°	149.7°
CAK	CAP	CAO	CAN	0.1°	0.0°
CAK	CAP	CAO	CAQ	179.8°	180.0°
CAK	CAP	CAQ	NAH	0.2°	0.5°
CAK	CAP	CAQ	OAR	180.0°	180.0°
CAP	CAK	CAL	H8	179.9°	180.0°
CAK	CAP	CAO	H11	179.9°	179.9°
CAN	CAO	CAP	H11	180.0°	180.0°
CAN	CAO	CAP	CAQ	179.9°	179.9°
CAO	CAN	CAM	H9	179.9°	180.0°
CAS	CAI	NAH	CAQ	179.8°	180.0°
CAS	CAI	NAH	CAG	0.4°	0.1°
CAI	CAS	H12	H13	120.0°	119.9°
CAI	CAS	H12	H14	120.0°	120.0°
CAI	CAS	H13	H14	120.0°	120.0°
CAI	NAH	CAQ	CAP	0.0°	0.6°
CAI	NAH	CAQ	CAG	179.9°	179.9°
CAI	NAH	CAQ	OAR	179.8°	180.0°
CAI	NAH	CAG	CAB	86.5°	89.9°
CAI	NAH	CAG	CAF	93.8°	90.3°
NAH	CAI	CAS	H12	179.6°	90.0°
NAH	CAI	CAS	H13	59.7°	150.0°
NAH	CAI	CAS	H14	60.3°	30.0°
CAO	CAP	CAQ	NAH	180.0°	179.5°
CAO	CAP	CAQ	OAR	0.2°	0.0°
CAP	CAO	CAN	H10	180.0°	179.9°
CAP	CAQ	NAH	OAR	179.8°	179.5°
CAP	CAQ	NAH	CAG	179.8°	179.5°
CAQ	CAP	CAO	H11	0.1°	0.1°
CAA	CAB	CAG	NAH	0.0°	0.1°
CAA	CAB	CAG	CAC	179.7°	179.8°
CAA	CAB	CAG	CAF	179.6°	179.7°
CAA	CAB	CAC	CAD	179.8°	180.0°
CAB	CAA	H1	H2	120.0°	120.0°
CAB	CAA	H1	H3	120.0°	120.0°
CAB	CAA	H2	H3	120.0°	120.0°
CAA	CAB	CAC	H4	0.2°	0.0°
CAQ	NAH	CAG	CAB	93.3°	90.0°
CAQ	NAH	CAG	CAF	86.3°	89.8°
CAG	NAH	CAQ	OAR	0.1°	0.1°
NAH	CAG	CAB	CAF	179.6°	179.8°
NAH	CAG	CAB	CAC	179.8°	179.7°
NAH	CAG	CAF	CAE	180.0°	179.7°
NAH	CAG	CAF	H7	0.0°	0.1°
CAG	CAB	CAC	CAD	0.1°	0.2°
CAB	CAG	CAF	CAE	0.3°	0.5°
CAG	CAB	CAA	H1	90.1°	90.0°
CAG	CAB	CAA	H2	149.9°	150.0°
CAG	CAB	CAA	H3	29.8°	30.0°
CAG	CAB	CAC	H4	180.0°	179.8°
CAB	CAG	CAF	H7	179.7°	179.7°
CAC	CAB	CAG	CAF	0.1°	0.5°
CAB	CAC	CAD	H4	180.0°	180.0°
CAB	CAC	CAD	CAE	0.1°	0.1°
CAC	CAB	CAA	H1	90.1°	89.8°
CAC	CAB	CAA	H2	29.9°	30.2°
CAC	CAB	CAA	H3	149.9°	150.3°
CAB	CAC	CAD	H5	179.9°	180.0°
CAG	CAF	CAE	H7	180.0°	179.8°
CAG	CAF	CAE	CAD	0.3°	0.2°
CAG	CAF	CAE	H6	179.7°	179.8°
CAC	CAD	CAE	CAF	0.1°	0.1°
CAC	CAD	CAE	H5	180.0°	179.9°
CAC	CAD	CAE	H6	179.9°	179.9°
CAF	CAE	CAD	H6	180.0°	180.0°
CAF	CAE	CAD	H5	179.9°	180.0°
CAE	CAD	CAC	H4	180.0°	179.9°
CAD	CAE	CAF	H7	179.7°	180.0°
H1	CAA	H2	H3	120.0°	120.0°
H4	CAC	CAD	H5	0.1°	0.0°
H5	CAD	CAE	H6	0.1°	0.0°
H6	CAE	CAF	H7	0.3°	0.0°
H8	CAL	CAM	H9	0.0°	0.0°
H9	CAM	CAN	H10	0.1°	0.1°
H10	CAN	CAO	H11	0.0°	0.0°
H12	CAS	H13	H14	120.0°	120.0°

Release date:	2024-06-26
Definition date:	2024-01-22
Last modified:	2024-06-21
Release status:	REL
Processing site:	RCSB
Derived from:	8VQY