8T7K

Apo HftA from Treponema denticola

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CHESS BEAMLINE 7B2
Synchrotron site	CHESS
Beamline	7B2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-02-22
Detector	DECTRIS EIGER2 X 16M
Wavelength(s)	0.9686
Spacegroup name	C 2 2 21
Unit cell lengths	54.735, 74.968, 79.803
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.620 - 1.780
R-factor	0.2163
Rwork	0.215
R-free	0.23940
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3pjl
RMSD bond length	0.007
RMSD bond angle	0.909
Data reduction software	autoPROC
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((1.20.1_4487: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	29.620	1.880
High resolution limit [Å]	1.780	1.780
Number of reflections	16097	2296
<I/σ(I)>	15.2	3.5
Completeness [%]	100.0
Redundancy	6.6
CC(1/2)	0.998	0.950

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		291	Sodium acetate, ammonium sulphate, glycerol