1DAE

DETHIOBIOTIN SYNTHETASE COMPLEXED WITH 3-(1-AMINOETHYL) NONANEDIOIC ACID

Experimental procedure

Detector technology	IMAGE PLATE
Collection date	1994-03-06
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	0.173 *
Rwork	0.178
RMSD bond length	0.014
RMSD bond angle	24.000 *
Data reduction software	R-AXIS
Phasing software	X-PLOR
Refinement software	X-PLOR

Data quality characteristics

	Overall
High resolution limit [Å]	1.700 *
Rmerge	0.050
Total number of observations	60324 *
Number of reflections	23576 *
Completeness [%]	95.0 *
Redundancy	2.6

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	AEND	5 (mM)
2	1	1		200 (mM)	or 100mM MnCl2