7WFS

Acyl-Coenzyme A Binding Protein 103 (LMJF_17_0620) of Leishmania major in triclinic crystal form

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	RRCAT INDUS-2 BEAMLINE PX-BL21
Synchrotron site	RRCAT INDUS-2
Beamline	PX-BL21
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2018-12-17
Detector	MAR scanner 345 mm plate
Wavelength(s)	0.979490
Spacegroup name	P 1
Unit cell lengths	37.258, 37.980, 45.975
Unit cell angles	89.68, 66.13, 60.72

Refinement procedure

Resolution	22.730 - 1.400
R-factor	0.2332
Rwork	0.232
R-free	0.26500
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7des
RMSD bond length	0.009
RMSD bond angle	0.983
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	40.800	1.420
High resolution limit [Å]	1.400	1.400
Number of reflections	36124	1722
<I/σ(I)>	16.5
Completeness [%]	93.9
Redundancy	1.8
CC(1/2)	0.990	0.816

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	289.15	0.1M TrisCl 2M Ammonium sulfate