7QPK

Structure of the A-region of Awp14 from Candida glabrata

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE ID23-1
Synchrotron site	ESRF
Beamline	ID23-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-05-17
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.972
Spacegroup name	C 2 2 21
Unit cell lengths	78.167, 172.807, 140.854
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.980 - 2.750
R-factor	0.1806
Rwork	0.178
R-free	0.24330
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	AF2 model
RMSD bond length	0.011
RMSD bond angle	1.337
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX (1.20_4459)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.980	2.900
High resolution limit [Å]	2.750	2.750
Rmerge	0.119	0.617
Rmeas	0.156	0.818
Rpim	0.082	0.441
Number of reflections	24047	10894
<I/σ(I)>	7.2	1.8
Completeness [%]	96.3
Redundancy	3.2
CC(1/2)	0.990	0.571

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.5	291	0.1 M BES/TEA pH 7.5, 10% (w/v) PEG 8000, 20% 1,5-pentanediol, Amino-acid II (1:10) of Morpheus II