6DSW

Bst DNA polymerase I pre-chemistry (n) structure

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 8.2.2
Synchrotron site	ALS
Beamline	8.2.2
Temperature [K]	100
Detector technology	CCD
Collection date	2017-10-24
Detector	ADSC QUANTUM 315r
Wavelength(s)	1
Spacegroup name	P 21 21 21
Unit cell lengths	86.139, 93.410, 105.619
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	63.324 - 1.589
R-factor	0.166
Rwork	0.166
R-free	0.18970
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1l3s
RMSD bond length	0.006
RMSD bond angle	0.821
Data reduction software	autoXDS
Data scaling software	autoXDS
Phasing software	PHASER
Refinement software	PHENIX ((1.11.1_2575: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	64.000	1.646
High resolution limit [Å]	1.589	1.589
Rmerge	0.730	1.350
Number of reflections	115054	11362
<I/σ(I)>	71.43
Completeness [%]	100.0
Redundancy	31.3
CC(1/2)	0.827	0.794

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	50% ammonium sulfate, 0.1M MES, 2% MPD