9HH8

Crystal Structure of the Plasmodium vivax Bromodomain PvBDP1 in complex with RMM23

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SLS BEAMLINE X06SA
Synchrotron site	SLS
Beamline	X06SA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-06-23
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.999987
Spacegroup name	P 62 2 2
Unit cell lengths	92.883, 92.883, 70.497
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	46.440 - 1.610
R-factor	0.194
Rwork	0.193
R-free	0.21600
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.015
RMSD bond angle	1.142
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21_5207)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	46.440	1.630
High resolution limit [Å]	1.610	1.610
Rmerge	0.063	3.092
Rmeas	0.064	3.135
Rpim	0.010	0.506
Total number of observations		41678
Number of reflections	23916	1122
<I/σ(I)>	34.4	1.5
Completeness [%]	99.9
Redundancy	39.1	37.1
CC(1/2)	1.000	0.854

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		277	35% PEG 3350, 0.4 M LiSO4, Tris pH 7.5