7P31

Plasmodium falciparum Hsp70-x chaperone nucleotide binding domain in complex with NCL-00023818

Replaces:  7OOHReplaces:  7NQX

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I04-1
Synchrotron site	Diamond
Beamline	I04-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-07-13
Detector	DECTRIS PILATUS 6M-F
Wavelength(s)	0.9159
Spacegroup name	P 21 21 21
Unit cell lengths	79.979, 102.575, 103.829
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	72.970 - 2.360
R-factor	0.2206
Rwork	0.220
R-free	0.23550
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	6rzq
RMSD bond length	0.008
RMSD bond angle	0.970
Data reduction software	DIALS
Data scaling software	DIALS
Phasing software	PHASER
Refinement software	BUSTER (2.10.4 (24-FEB-2021))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	79.980	2.400
High resolution limit [Å]	2.360	2.360
Rmeas	0.130	2.176
Number of reflections	35843	1745
<I/σ(I)>	8	1
Completeness [%]	100.0	100
Redundancy	6.5	6
CC(1/2)	1.000	0.500

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.4	293	20 mM HEPES pH 7.4 50 mM NaCl 1 mM DTT 3.5 mM AMP-PNP 24% w/v PEG 1500 20% v/v glycerol