8GZ0

Structure of hypothetical protein TTHA1873 with phosphate from Thermus thermophilus

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2019-07-16
Detector	MAR scanner 345 mm plate
Wavelength(s)	1.5418
Spacegroup name	P 61 2 2
Unit cell lengths	90.010, 90.010, 140.671
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	52.270 - 2.220
R-factor	0.1761
Rwork	0.174
R-free	0.21290
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7wwo
RMSD bond length	0.007
RMSD bond angle	1.238
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0352)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	52.270	2.290
High resolution limit [Å]	2.220	2.220
Number of reflections	17209	1271
<I/σ(I)>	3.6
Completeness [%]	98.2
Redundancy	33.5
CC(1/2)	0.998	0.864

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		277	60% v/v Tacismate