9BC4

Transglutaminase 2 - Intermediate State

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRL BEAMLINE BL12-2
Synchrotron site	SSRL
Beamline	BL12-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-04-11
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.97946
Spacegroup name	P 1 21 1
Unit cell lengths	46.430, 69.810, 77.780
Unit cell angles	90.00, 107.24, 90.00

Refinement procedure

Resolution	37.430 - 1.840
R-factor	0.18848
Rwork	0.186
R-free	0.23010
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	1.510
Data reduction software	XDS
Data scaling software	XSCALE
Phasing software	PHASER
Refinement software	REFMAC (5.8.0425)

Data quality characteristics

	Overall	Inner shell	Outer shell
Low resolution limit [Å]	37.430	37.430	1.890
High resolution limit [Å]	1.840	8.230	1.840
Rmerge	0.111	0.046	0.853
Rmeas	0.129	0.054	0.992
Number of reflections	40758	490	2985
<I/σ(I)>	7.5
Completeness [%]	98.6
Redundancy	3.9
CC(1/2)	0.994	0.994	0.737

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		298	15% PEG4K, 0.15 M Ammonium sulfate, 0.1 M HEPES (pH 7.0).