10LX

High Stable Quinonoid Intermediate of Human Ornithine Aminotransferase Complexed with (1R,4S)-4-Amino-3-(trifluoromethyl)cyclopent-2-ene-1-carboxylic Acid

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 21-ID-D
Synchrotron site	APS
Beamline	21-ID-D
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-11-26
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.920105
Spacegroup name	P 32 2 1
Unit cell lengths	115.520, 115.520, 187.440
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	34.200 - 1.830
R-factor	0.2007
Rwork	0.199
R-free	0.23390
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.006
RMSD bond angle	0.839
Data reduction software	autoPROC
Data scaling software	autoPROC
Phasing software	PHASER
Refinement software	PHENIX (1.21.2_5419)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	34.200	1.858
High resolution limit [Å]	1.830	1.830
Number of reflections	128275	6311
<I/σ(I)>	12.7
Completeness [%]	100.0
Redundancy	19
CC(1/2)	0.999	0.426

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	7.25%-8.50% PEG 6000, 100 mM-250 mM NaCl, 2-3.5% glycerol, and 100 mM Tricine pH 7.8.