5YUT

DNA polymerase IV - DNA ternary complex 3

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ESRF BEAMLINE BM14
Synchrotron site	ESRF
Beamline	BM14
Temperature [K]	100
Detector technology	CCD
Collection date	2016-09-16
Detector	MAR CCD 130 mm
Wavelength(s)	0.95372
Spacegroup name	P 1 21 1
Unit cell lengths	86.750, 56.930, 110.210
Unit cell angles	90.00, 95.12, 90.00

Refinement procedure

Resolution	54.885 - 2.150
R-factor	0.1903
Rwork	0.188
R-free	0.23790
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	4ir1
RMSD bond length	0.008
RMSD bond angle	1.051
Data reduction software	iMOSFLM
Data scaling software	SCALA
Phasing software	PHASER
Refinement software	PHENIX ((1.10.1_2155: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	71.040	2.270
High resolution limit [Å]	2.150	2.150
Rmerge	0.079	0.558
Number of reflections	58767	8531
<I/σ(I)>	10.8	2.5
Completeness [%]	100.0	100
Redundancy	4.3	4.1
CC(1/2)	0.996	0.734

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	5.2	298	15% MPD , pH 5.2, VAPOR DIFFUSION, HANGING DROP, temperature 298K