8RQG

Histidine-containing phosphotransfer protein from Chaetomium termophilum mutant H105E

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	DIAMOND BEAMLINE I03
Synchrotron site	Diamond
Beamline	I03
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-10-18
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.97918
Spacegroup name	P 64 2 2
Unit cell lengths	100.575, 100.575, 65.274
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	87.100 - 2.400
R-factor	0.21371
Rwork	0.211
R-free	0.26419
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.005
RMSD bond angle	1.141
Data reduction software	XDS
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	REFMAC (5.8.0403)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	87.100	2.490
High resolution limit [Å]	2.400	2.400
Rmerge	0.200
Rmeas	0.203
Rpim	0.028
Number of reflections	8055	825
<I/σ(I)>	27.5
Completeness [%]	100.0
Redundancy	51.2
CC(1/2)	1.000	0.799

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		294	500 mM Ammonium dihydrogen Phosphate 200 mM Sodium Citrate