7FZQ

Crystal Structure of human FABP3 in complex with myristate

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X10SA
Synchrotron site	SLS
Beamline	X10SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2010-10-21
Detector	PSI PILATUS 6M
Wavelength(s)	1.000000
Spacegroup name	C 1 2 1
Unit cell lengths	134.852, 29.864, 81.060
Unit cell angles	90.00, 122.36, 90.00

Refinement procedure

Resolution	35.445 - 1.597
R-factor	0.2538
Rwork	0.252
R-free	0.29350
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	inhouse model
RMSD bond length	0.007
RMSD bond angle	1.012
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.6.4_486)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	35.450	35.445	1.740
High resolution limit [Å]	1.597	7.590	1.597
Rmerge	0.095	0.033	0.587
Rmeas	0.114	0.039	0.709
Total number of observations	99576
Number of reflections	36682	381	2110
<I/σ(I)>	8.53	22.6	1.71
Completeness [%]	98.4	96	93.1
Redundancy	3.267	3.089	2.994
CC(1/2)	0.995	0.998	0.749

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7	293	protein in 25mM Tris/HCl pH 7.5 100mM NaCl, see also PMID 27658368