6YS2

Crystal structure of FAP R451A 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	2018-09-26
Detector	DECTRIS EIGER X 4M
Wavelength(s)	0.97625
Spacegroup name	P 21 21 21
Unit cell lengths	58.950, 60.820, 180.150
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	49.375 - 1.970
Rwork	0.182
R-free	0.22870
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6yru
RMSD bond length	0.009
RMSD bond angle	1.618
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]	86.000	86.000	2.090
High resolution limit [Å]	1.970	5.870	1.970
Rmerge	0.134	0.042	1.010
Rmeas	0.150	0.047	1.131
Number of reflections	46463	1915	7384
<I/σ(I)>	8.56	27.96	1.44
Completeness [%]	99.5	98.4	99
Redundancy	4.848	4.24	4.871
CC(1/2)	0.996	0.998	0.568

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