9PRP

N-terminal domain of E. coli MutL bound to NP660

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	CLSI BEAMLINE 08B1-1
Synchrotron site	CLSI
Beamline	08B1-1
Temperature [K]	100
Detector technology	CCD
Collection date	2019-06-27
Detector	RAYONIX MX300HE
Wavelength(s)	1.0332
Spacegroup name	P 1 21 1
Unit cell lengths	69.126, 69.694, 74.718
Unit cell angles	90.00, 113.74, 90.00

Refinement procedure

Resolution	48.820 - 2.100
R-factor	0.2404
Rwork	0.237
R-free	0.29540
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	0.885
Data reduction software	DIALS (v3-16-0)
Data scaling software	DIALS (v3-16-0)
Phasing software	PHENIX (1.20.1_4487)
Refinement software	PHENIX (1.20.1_4487)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	48.820	2.160
High resolution limit [Å]	2.100	2.100
Rmerge	0.102
Rmeas	0.119
Rpim	0.061
Number of reflections	37503	2836
<I/σ(I)>	8.27
Completeness [%]	97.7	97.01
Redundancy	3.9	3.9
CC(1/2)	0.998	0.584

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	6	295	21% PEG3350, 200 mM ammonium tartrate, 100 mM Bis-Tris, pH 6.0