6OJZ

PilT4 from Geobacter metallireducens bound to ADP with partial occupancy: C3ocococ conformation

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSLS-II BEAMLINE 17-ID-2
Synchrotron site	NSLS-II
Beamline	17-ID-2
Temperature [K]	100
Detector technology	PIXEL
Collection date	2017-07-12
Detector	DECTRIS EIGER X 16M
Wavelength(s)	1.2821
Spacegroup name	P 21 21 21
Unit cell lengths	112.335, 121.134, 187.112
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	29.894 - 3.027
R-factor	0.196
Rwork	0.195
R-free	0.23210
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3jvv
RMSD bond length	0.008
RMSD bond angle	1.077
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHASER
Refinement software	PHENIX ((1.14_3260: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	3.100
High resolution limit [Å]	3.000	3.000
Rpim	0.047	0.243
Number of reflections	49747	4342
<I/σ(I)>	12
Completeness [%]	98.0
Redundancy	12.5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP	7.1	293	5.75 % (w/v) PEG3350 100 mM L-proline 50 mM Hepes pH 7.1 100 mM NaCl 25 mM Hepes pH 8.0