8SCG

Bst DNA polymerase I Large Fragment mutant F710Y/D598A with 3'-amino primer, dGTP, and calcium time-resolved 0h (Ground State)

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]	99
Detector technology	CCD
Collection date	2020-10-01
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.0000
Spacegroup name	P 21 21 21
Unit cell lengths	93.679, 108.814, 149.552
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	45.320 - 2.000
R-factor	0.2044
Rwork	0.202
R-free	0.24520
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.007
RMSD bond angle	0.907
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.050
High resolution limit [Å]	2.000	2.000
Rmerge	0.109	0.449
Rmeas	0.116	0.479
Rpim	0.039	0.162
Number of reflections	99476	6410
<I/σ(I)>	16.7	5.7
Completeness [%]	96.5	88.4
Redundancy	9	7.8
CC(1/2)	0.981	0.918

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		293	2 M ammonium sulphate, 0.1 M MES pH 5.3-6.0, 20 mM CaCl2, 5% MPD