9XQ6

Maltose-binding protein

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SPRING-8 BEAMLINE BL26B1
Synchrotron site	SPring-8
Beamline	BL26B1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2024-07-19
Detector	DECTRIS EIGER R 4M
Wavelength(s)	1.00
Spacegroup name	P 1 21 1
Unit cell lengths	70.886, 64.296, 82.270
Unit cell angles	90.00, 96.37, 90.00

Refinement procedure

Resolution	40.880 - 1.920
R-factor	0.1944
Rwork	0.192
R-free	0.24370
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	AlphaFold
RMSD bond length	0.008
RMSD bond angle	0.863
Data reduction software	XDS
Data scaling software	XDS
Phasing software	PHENIX
Refinement software	PHENIX ((1.21.1_5286: ???))

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	47.490	1.970
High resolution limit [Å]	1.920	1.920
Rmeas	0.053	0.741
Rpim	0.031	0.435
Number of reflections	55743	3672
<I/σ(I)>	12	1.8
Completeness [%]	99.0
Redundancy	4.5
CC(1/2)	0.999	0.652

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	EVAPORATION	7.5	293	1.4 M sodium citrate