8YK8

adenosylcobinamide kinase/adenosylcobinamide phosphate guanylyltransferase -C91S

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	PAL/PLS BEAMLINE 5C (4A)
Synchrotron site	PAL/PLS
Beamline	5C (4A)
Temperature [K]	100
Detector technology	PIXEL
Collection date	2023-10-18
Detector	DECTRIS EIGER X 9M
Wavelength(s)	0.97934
Spacegroup name	P 63
Unit cell lengths	60.970, 60.970, 73.392
Unit cell angles	90.00, 90.00, 120.00

Refinement procedure

Resolution	28.169 - 1.500
Rwork	0.205
R-free	0.23890
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.013
RMSD bond angle	1.905
Data reduction software	XDS
Data scaling software	XDS
Phasing software	MOLREP
Refinement software	REFMAC (5.8.0267)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.169	1.530
High resolution limit [Å]	1.500	1.500
Rmerge	0.050
Number of reflections	24858	1253
<I/σ(I)>	33.6
Completeness [%]	100.0
Redundancy	20.3
CC(1/2)	1.000	1.000

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		294	0.49M Sodium phosphate monobasic monohydrate, 0.91M Potassium phosphate dibasic