ZXD

Bonds

First atom	Second atom	Bond order type	Distance (experimental model)	Distance (ideal model)	Properties
CAA	CAH	sing	1.53Å	1.53Å
CAH	CAB	sing	1.53Å	1.53Å
CAH	CAL	sing	1.53Å	1.53Å
CAL	NAG	sing	1.47Å	1.47Å
CAL	CAK	sing	1.53Å	1.53Å
NAG	CAF	sing	1.47Å	1.47Å
CAF	CAI	sing	1.53Å	1.53Å
CAI	OAC	sing	1.43Å	1.43Å
CAI	CAJ	sing	1.53Å	1.53Å
CAJ	OAD	sing	1.43Å	1.43Å
CAJ	CAK	sing	1.53Å	1.53Å
CAK	OAE	sing	1.43Å	1.43Å
CAA	HAA	sing	1.09Å	1.10Å
CAA	HAAA	sing	1.09Å	1.10Å
CAA	HAAB	sing	1.09Å	1.10Å
CAH	HAH	sing	1.09Å	1.10Å
CAB	HAB	sing	1.09Å	1.10Å
CAB	HABA	sing	1.09Å	1.10Å
CAB	HABB	sing	1.09Å	1.10Å
CAL	HAL	sing	1.09Å	1.10Å
NAG	HNAG	sing	1.01Å	1.00Å
CAF	HAF	sing	1.09Å	1.10Å
CAF	HAFA	sing	1.09Å	1.10Å
CAI	HAI	sing	1.09Å	1.10Å
OAC	HOAC	sing	0.97Å	0.95Å
CAJ	HAJ	sing	1.09Å	1.10Å
OAD	HOAD	sing	0.97Å	0.95Å
CAK	HAK	sing	1.09Å	1.10Å
OAE	HOAE	sing	0.97Å	0.95Å

Angles

First atom	Second atom	Third atom	Angle (experimental model)	Angle (ideal model)
CAA	CAH	CAB	109.0°	109.5°
CAA	CAH	CAL	109.8°	109.5°
CAH	CAA	HAA	109.5°	109.5°
CAH	CAA	HAAA	109.5°	109.5°
CAH	CAA	HAAB	109.4°	109.4°
CAA	CAH	HAH	110.2°	109.4°
CAB	CAH	CAL	111.2°	109.5°
CAB	CAH	HAH	108.7°	109.5°
CAH	CAB	HAB	109.5°	109.5°
CAH	CAB	HABA	109.4°	109.5°
CAH	CAB	HABB	109.5°	109.4°
CAH	CAL	NAG	110.5°	109.4°
CAH	CAL	CAK	112.5°	109.5°
CAL	CAH	HAH	108.0°	109.5°
CAH	CAL	HAL	106.9°	109.5°
NAG	CAL	CAK	110.3°	109.5°
CAL	NAG	CAF	110.8°	111.2°
NAG	CAL	HAL	109.3°	109.4°
CAL	NAG	HNAG	109.0°	111.0°
CAL	CAK	CAJ	109.3°	109.3°
CAL	CAK	OAE	109.3°	109.5°
CAK	CAL	HAL	107.2°	109.5°
CAL	CAK	HAK	109.5°	109.5°
NAG	CAF	CAI	108.7°	109.6°
CAF	NAG	HNAG	109.0°	111.0°
NAG	CAF	HAF	109.7°	109.5°
NAG	CAF	HAFA	109.9°	109.5°
CAF	CAI	OAC	110.7°	109.5°
CAF	CAI	CAJ	109.2°	109.2°
CAI	CAF	HAF	109.7°	109.4°
CAI	CAF	HAFA	109.9°	109.4°
CAF	CAI	HAI	108.9°	109.5°
OAC	CAI	CAJ	109.7°	109.5°
OAC	CAI	HAI	108.4°	109.5°
CAI	OAC	HOAC	109.5°	114.0°
CAI	CAJ	OAD	109.9°	109.5°
CAI	CAJ	CAK	108.6°	109.2°
CAJ	CAI	HAI	109.9°	109.5°
CAI	CAJ	HAJ	110.0°	109.5°
OAD	CAJ	CAK	110.2°	109.6°
OAD	CAJ	HAJ	108.4°	109.5°
CAJ	OAD	HOAD	109.5°	114.0°
CAJ	CAK	OAE	109.0°	109.5°
CAK	CAJ	HAJ	109.7°	109.6°
CAJ	CAK	HAK	109.8°	109.5°
OAE	CAK	HAK	109.8°	109.5°
CAK	OAE	HOAE	109.5°	114.0°
HAA	CAA	HAAA	109.5°	109.4°
HAA	CAA	HAAB	109.5°	109.5°
HAAA	CAA	HAAB	109.5°	109.5°
HAB	CAB	HABA	109.4°	109.5°
HAB	CAB	HABB	109.5°	109.5°
HABA	CAB	HABB	109.5°	109.5°
HAF	CAF	HAFA	108.9°	109.4°

Dihedrals

First atom	Second atom	Third atom	Fourth atom	Torsion (experimental model)	Torsion (ideal model)
CAA	CAH	CAB	CAL	121.1°	120.0°
CAA	CAH	CAB	HAH	120.1°	120.0°
CAA	CAH	CAL	HAH	120.1°	120.0°
CAA	CAH	CAL	NAG	70.6°	175.7°
CAA	CAH	CAL	CAK	165.7°	64.3°
CAH	CAA	HAA	HAAA	120.0°	120.0°
CAH	CAA	HAA	HAAB	120.0°	119.9°
CAH	CAA	HAAA	HAAB	120.0°	120.0°
CAA	CAH	CAB	HAB	171.1°	55.3°
CAA	CAH	CAB	HABA	51.1°	175.4°
CAA	CAH	CAB	HABB	68.9°	64.7°
CAA	CAH	CAL	HAL	48.3°	55.8°
CAB	CAH	CAL	HAH	119.2°	120.1°
CAB	CAH	CAL	NAG	50.1°	55.8°
CAB	CAH	CAL	CAK	73.6°	175.8°
CAB	CAH	CAA	HAA	54.4°	60.0°
CAB	CAH	CAA	HAAA	65.6°	60.0°
CAB	CAH	CAA	HAAB	174.5°	179.9°
CAH	CAB	HAB	HABA	120.0°	120.0°
CAH	CAB	HAB	HABB	120.0°	120.0°
CAH	CAB	HABA	HABB	120.0°	119.9°
CAB	CAH	CAL	HAL	169.0°	64.2°
CAH	CAL	NAG	CAK	125.0°	120.0°
CAH	CAL	NAG	HAL	117.4°	120.0°
CAH	CAL	CAK	HAL	117.3°	120.1°
CAH	CAL	NAG	CAF	174.0°	178.3°
CAH	CAL	CAK	CAJ	177.7°	179.2°
CAH	CAL	CAK	OAE	63.0°	59.2°
CAL	CAH	CAA	HAA	67.6°	60.0°
CAL	CAH	CAA	HAAA	172.4°	180.0°
CAL	CAH	CAA	HAAB	52.4°	60.0°
CAL	CAH	CAB	HAB	67.8°	64.6°
CAL	CAH	CAB	HABA	172.2°	55.4°
CAL	CAH	CAB	HABB	52.2°	175.4°
CAH	CAL	NAG	HNAG	66.0°	57.7°
CAH	CAL	CAK	HAK	57.3°	60.9°
NAG	CAL	CAK	HAL	118.9°	120.0°
CAL	NAG	CAF	HNAG	120.0°	124.1°
CAL	NAG	CAF	CAI	62.1°	61.8°
NAG	CAL	CAK	CAJ	58.4°	59.2°
NAG	CAL	CAK	OAE	60.8°	60.8°
NAG	CAL	CAH	HAH	169.3°	64.3°
CAL	NAG	CAF	HAF	177.9°	178.2°
CAL	NAG	CAF	HAFA	58.2°	58.2°
NAG	CAL	CAK	HAK	178.8°	179.1°
CAK	CAL	NAG	CAF	61.0°	61.8°
CAL	CAK	CAJ	CAI	57.6°	57.7°
CAL	CAK	CAJ	OAD	178.1°	177.6°
CAL	CAK	CAJ	OAE	119.5°	120.0°
CAL	CAK	CAJ	HAK	120.2°	119.9°
CAL	CAK	OAE	HAK	120.2°	120.1°
CAK	CAL	CAH	HAH	45.6°	55.7°
CAK	CAL	NAG	HNAG	59.0°	62.3°
CAL	CAK	CAJ	HAJ	62.6°	62.2°
CAL	CAK	OAE	HOAE	137.9°	180.0°
NAG	CAF	CAI	HAF	120.0°	120.0°
NAG	CAF	CAI	HAFA	120.3°	120.0°
NAG	CAF	CAI	OAC	177.8°	179.1°
NAG	CAF	CAI	CAJ	61.3°	59.2°
CAF	NAG	CAL	HAL	56.6°	58.2°
NAG	CAF	HAF	HAFA	120.3°	120.0°
NAG	CAF	CAI	HAI	58.7°	60.8°
CAF	CAI	OAC	CAJ	120.6°	119.8°
CAF	CAI	OAC	HAI	119.4°	120.1°
CAF	CAI	CAJ	HAI	119.4°	119.9°
CAF	CAI	CAJ	OAD	179.9°	177.6°
CAF	CAI	CAJ	CAK	59.5°	57.6°
CAI	CAF	NAG	HNAG	57.9°	62.3°
CAI	CAF	HAF	HAFA	120.3°	119.9°
CAF	CAI	OAC	HOAC	2.7°	60.0°
CAF	CAI	CAJ	HAJ	60.6°	62.4°
OAC	CAI	CAJ	HAI	119.1°	120.1°
OAC	CAI	CAJ	OAD	58.4°	62.5°
OAC	CAI	CAJ	CAK	179.0°	177.6°
OAC	CAI	CAF	HAF	57.8°	60.8°
OAC	CAI	CAF	HAFA	61.9°	59.1°
OAC	CAI	CAJ	HAJ	60.9°	57.6°
CAI	CAJ	OAD	CAK	119.6°	119.7°
CAI	CAJ	OAD	HAJ	120.3°	120.0°
CAI	CAJ	CAK	HAJ	120.3°	119.9°
CAI	CAJ	CAK	OAE	61.8°	62.3°
CAJ	CAI	CAF	HAF	178.7°	179.2°
CAJ	CAI	CAF	HAFA	59.0°	60.9°
CAJ	CAI	OAC	HOAC	123.2°	179.8°
CAI	CAJ	OAD	HOAD	79.9°	60.0°
CAI	CAJ	CAK	HAK	177.8°	177.6°
OAD	CAJ	CAK	HAJ	119.3°	120.2°
OAD	CAJ	CAK	OAE	58.7°	57.6°
OAD	CAJ	CAI	HAI	60.7°	57.7°
OAD	CAJ	CAK	HAK	61.7°	62.5°
CAJ	CAK	OAE	HAK	120.4°	120.1°
CAJ	CAK	CAL	HAL	60.5°	60.7°
CAK	CAJ	CAI	HAI	60.0°	62.3°
CAK	CAJ	OAD	HOAD	160.4°	179.6°
CAJ	CAK	OAE	HOAE	102.7°	60.2°
OAE	CAK	CAL	HAL	179.7°	179.3°
OAE	CAK	CAJ	HAJ	177.9°	177.8°
HAA	CAA	HAAA	HAAB	120.0°	120.0°
HAA	CAA	CAH	HAH	173.7°	180.0°
HAAA	CAA	CAH	HAH	53.6°	60.0°
HAAB	CAA	CAH	HAH	66.3°	60.0°
HAH	CAH	CAB	HAB	50.9°	175.3°
HAH	CAH	CAB	HABA	69.0°	64.7°
HAH	CAH	CAB	HABB	171.0°	55.3°
HAH	CAH	CAL	HAL	71.8°	175.8°
HAB	CAB	HABA	HABB	120.0°	120.0°
HAL	CAL	NAG	HNAG	176.6°	177.7°
HAL	CAL	CAK	HAK	59.9°	59.2°
HNAG	NAG	CAF	HAF	62.1°	57.7°
HNAG	NAG	CAF	HAFA	178.2°	177.6°
HAF	CAF	CAI	HAI	61.3°	59.2°
HAFA	CAF	CAI	HAI	179.0°	179.2°
HAI	CAI	OAC	HOAC	116.7°	60.1°
HAI	CAI	CAJ	HAJ	180.0°	177.7°
HAJ	CAJ	OAD	HOAD	40.3°	60.1°
HAJ	CAJ	CAK	HAK	57.6°	57.7°
HAK	CAK	OAE	HOAE	17.7°	59.9°

Definition date:	2008-12-24
Last modified:	2011-06-04
Release status:	REL
Processing site:	PDBJ
Derived from:	2ZXD