8T7L

Copper bound HftA from Treponema denticola

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08ID-1
Synchrotron site	CLSI
Beamline	08ID-1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2022-08-04
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.95374
Spacegroup name	P 21 21 21
Unit cell lengths	31.510, 78.160, 150.270
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	42.170 - 1.890
R-factor	0.2091
Rwork	0.208
R-free	0.23300
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3pjl
RMSD bond length	0.007
RMSD bond angle	0.912
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]	42.170	1.990
High resolution limit [Å]	1.890	1.890
Rmerge	0.139	0.080
Number of reflections	30767	1100
<I/σ(I)>	11.9
Completeness [%]	99.9	99.2
Redundancy	12.6	11.3
CC(1/2)	0.997	0.997

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	4.6	291	Sodium citrate, Ammonium sulphate, glycerol