7R9B

Crystal structure of Triosephosphate isomerase from Candidatus Roizmanbacteria

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	AUSTRALIAN SYNCHROTRON BEAMLINE MX1
Synchrotron site	Australian Synchrotron
Beamline	MX1
Temperature [K]	100
Detector technology	CCD
Collection date	2020-09-30
Detector	ADSC QUANTUM 210r
Wavelength(s)	0.95372
Spacegroup name	P 31 2 1
Unit cell lengths	108.937, 108.937, 41.015
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	37.610 - 2.200
R-factor	0.1892
Rwork	0.187
R-free	0.23020
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1yya
RMSD bond length	0.007
RMSD bond angle	0.940
Data reduction software	iMOSFLM
Data scaling software	Aimless
Phasing software	PHENIX
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	41.010	2.260
High resolution limit [Å]	2.200	2.200
Number of reflections	14485	1205
<I/σ(I)>	35.3
Completeness [%]	99.8
Redundancy	20.5
CC(1/2)	1.000	0.953

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		291.15	0.1 M phosphate/citrate pH 4.2, 40% v/v PEG 300.