9D5D

Crystal Structure of Blood Coagulation Factor VIII C2 Domain Mutant L2251A/L2252A

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	ALS BEAMLINE 5.0.1
Synchrotron site	ALS
Beamline	5.0.1
Temperature [K]	100
Detector technology	CCD
Collection date	2023-10-18
Detector	ADSC QUANTUM 315
Wavelength(s)	0.97
Spacegroup name	P 43 21 2
Unit cell lengths	49.962, 49.962, 116.565
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	37.930 - 1.830
R-factor	0.19
Rwork	0.186
R-free	0.22290
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.008
RMSD bond angle	1.067
Data reduction software	APEX
Data scaling software	Aimless
Phasing software	PHENIX (v1.21.1)
Refinement software	PHENIX (v1.21.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.930	1.900
High resolution limit [Å]	1.830	1.830
Rmerge	0.151	0.689
Rmeas	0.155	0.730
Rpim	0.032	0.231
Number of reflections	13614	1248
<I/σ(I)>	15.3	2.8
Completeness [%]	99.2	93.06
Redundancy	20.8	9.3
CC(1/2)	0.998	0.841

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	4 M potassium formate, 0.1 M Bis-Tris propane, pH 9, 2% w/v PEG2000 MME