1DAF

DETHIOBIOTIN SYNTHETASE COMPLEXED WITH 7-(CARBOXYAMINO)-8-AMINO-NONANOIC ACID, ADP, AND CALCIUM

Experimental procedure

Detector technology	IMAGE PLATE
Collection date	1994-02-26
Detector	RIGAKU RAXIS II
Spacegroup name	C 1 2 1
Unit cell lengths	73.200, 49.200, 61.800
Unit cell angles	90.00, 107.10, 90.00

Refinement procedure

Resolution	6.000 - 1.700
R-factor	0.172
Rwork	0.172
RMSD bond length	0.014
RMSD bond angle	24.200 *
Data reduction software	R-AXIS
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall
High resolution limit [Å]	1.700 *
Rmerge	0.059
Total number of observations	52543 *
Number of reflections	21243
Completeness [%]	93.0
Redundancy	2.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	other *			cocrystallization *

Crystallization Reagents in Literatures

ID	crystal ID	solution	reagent name	concentration (unit)	details
1	1	1	DAPA	5 (mM)
2	1	1		200 (mM)	or 100mM MnCl2