7E25

Crystal structure of human FABP7 complexed with palmitic acid

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	CCD
Collection date	2018-04-20
Detector	ADSC QUANTUM 315
Wavelength(s)	0.9795
Spacegroup name	C 1 2 1
Unit cell lengths	91.895, 45.356, 42.846
Unit cell angles	90.00, 98.79, 90.00

Refinement procedure

Resolution	30.350 - 1.600
R-factor	0.1754
Rwork	0.173
R-free	0.19770
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1fe3
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	MOLREP
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	1.660
High resolution limit [Å]	1.600	1.600
Rmerge	0.081	0.316
Rpim	0.052	0.215
Number of reflections	22336	1854
<I/σ(I)>	31.76	3.71
Completeness [%]	96.4	81
Redundancy	3.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8.5	295.5	Tris-HCl, ammonium sulfate