6KXH

Alp1U_Y247F mutant in complex with Fluostatin C

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-06-28
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.97853
Spacegroup name	P 21 21 21
Unit cell lengths	97.477, 101.562, 117.481
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	31.980 - 1.780
R-factor	0.171638507138
Rwork	0.170
R-free	0.20619
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.087
Data reduction software	HKL-3000
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.9_1692+SVN)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	31.980	1.844
High resolution limit [Å]	1.780	1.780
Number of reflections	111803	10937
<I/σ(I)>	16.18
Completeness [%]	99.9
Redundancy	1.1
CC(1/2)	1.000	1.000

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	0.1M MMT PH5.0, 25% PEG 1500