2CB8

High resolution crystal structure of liganded human L-ACBP

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID14-4
Synchrotron site	ESRF
Beamline	ID14-4
Temperature [K]	100
Detector technology	CCD
Collection date	2000-11-09
Detector	ADSC CCD
Spacegroup name	I 2 3
Unit cell lengths	118.490, 118.490, 118.490
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	18.290 - 1.400
R-factor	0.172
Rwork	0.171
R-free	0.19400
Structure solution method	SAD
RMSD bond length	0.011
RMSD bond angle	1.866
Data reduction software	XDS
Data scaling software	XDS
Phasing software	CNS
Refinement software	REFMAC (5.1.24)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	19.000	1.450
High resolution limit [Å]	1.350	1.350
Rmerge	0.060
Number of reflections	54202
<I/σ(I)>	13.9
Completeness [%]	99.8
Redundancy	5.44

Crystallization Conditions

crystal ID	method	pH	temperature	details
1		6.5		24% PEG-MME 550, 100 MM MES, PH 6.5, 10 MM ZNSO4