7BBV

Pectate lyase B from Verticillium dahliae

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SOLEIL BEAMLINE PROXIMA 2
Synchrotron site	SOLEIL
Beamline	PROXIMA 2
Temperature [K]	100.15
Detector technology	PIXEL
Collection date	2018-02-17
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.980
Spacegroup name	P 1 21 1
Unit cell lengths	60.890, 59.690, 93.870
Unit cell angles	90.00, 96.35, 90.00

Refinement procedure

Resolution	60.520 - 1.200
R-factor	0.1734
Rwork	0.172
R-free	0.19580
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3vmv
RMSD bond length	0.013
RMSD bond angle	1.400
Data reduction software	pointless
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	60.520	1.240
High resolution limit [Å]	1.200	1.200
Rmerge	0.014
Rmeas	0.020
Number of reflections	207729	19578
<I/σ(I)>	18.3
Completeness [%]	99.0	93.8
Redundancy	2
CC(1/2)	1.000	0.136

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	8	291.15	0.1 M MIB 8.0 25 % w/v PEG 1500 (B5 condition PACT premier plate)