7RPS

B. miyamotoi FbpB complement inhibitory domain

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	APS BEAMLINE 22-ID
Synchrotron site	APS
Beamline	22-ID
Temperature [K]	93
Detector technology	PIXEL
Collection date	2020-07-10
Detector	DECTRIS EIGER X 16M
Wavelength(s)	0.975
Spacegroup name	C 1 2 1
Unit cell lengths	62.724, 46.210, 59.562
Unit cell angles	90.00, 102.94, 90.00

Refinement procedure

Resolution	36.860 - 2.090
R-factor	0.2256
Rwork	0.222
R-free	0.25630
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	7rpr
RMSD bond length	0.010
RMSD bond angle	1.272
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX (1.18.2_3874)
Refinement software	PHENIX (1.18.2_3874)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.180
High resolution limit [Å]	2.090	2.090
Rmeas	0.115	0.424
Rpim	0.054	0.209
Number of reflections	9525	918
<I/σ(I)>	20.2	2.42
Completeness [%]	96.5	93.5
Redundancy	4.4
CC(1/2)	0.995	0.910

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION		277.15	4 mg/mL, 0.2M magnesium chloride, 0.1 tris (8.5), PEG 4000, 0.035 M spermidine