9BLV

Proteus vulgaris tryptophan indole-lyase complexed with L-Trp and benzimidazole

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-03-01
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	113.523, 109.962, 144.982
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	56.760 - 1.780
R-factor	0.2003
Rwork	0.198
R-free	0.24740
Structure solution method	MOLECULAR REPLACEMENT
Data reduction software	autoPROC
Data scaling software	Aimless
Phasing software	PHASER
Refinement software	PHENIX (1.21.1_5286)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	56.760	1.800
High resolution limit [Å]	1.776	1.776
Number of reflections	94968	4748
<I/σ(I)>	5.4	1.6
Completeness [%]	94.4
Redundancy	5.8
CC(1/2)	0.994	0.666

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	0.1 M potassium phosphate, pH 8, 0.2 M CsCl, 22% PEG 4000