6YS1

Crystal structure of FAP R451K mutant in the dark at 100K

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID29
Synchrotron site	ESRF
Beamline	ID29
Temperature [K]	100
Detector technology	PIXEL
Collection date	2018-06-28
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.966
Spacegroup name	I 2 2 2
Unit cell lengths	89.620, 102.780, 155.830
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	46.401 - 1.640
Rwork	0.166
R-free	0.19210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6yru
RMSD bond length	0.012
RMSD bond angle	1.798
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	90.000	90.000	1.750
High resolution limit [Å]	1.640	4.620	1.640
Rmerge	0.072	0.025	0.853
Rmeas	0.083	0.028	0.984
Number of reflections	87644	4140	15347
<I/σ(I)>	12.22	41.83	1.52
Completeness [%]	99.5	98.8	99.5
Redundancy	4.232	4.304	4.041
CC(1/2)	0.998	0.999	0.537

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	5.5	281	PEG 4000 25-40%, Na citrate 100 mM, spermidine 10mM