7YM1

Structure of SsbA protein in complex with the anticancer drug 5-fluorouracil

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	NSRRC BEAMLINE BL15A1
Synchrotron site	NSRRC
Beamline	BL15A1
Temperature [K]	298
Detector technology	CCD
Collection date	2022-04-21
Detector	RAYONIX MX300-HS
Wavelength(s)	1
Spacegroup name	P 41 21 2
Unit cell lengths	88.091, 88.091, 57.785
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	27.860 - 2.360
R-factor	0.2037
Rwork	0.201
R-free	0.25780
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	5xgt
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (1.19.1_4122)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	30.000	2.440
High resolution limit [Å]	2.360	2.360
Rmerge	0.067
Number of reflections	9854	964
<I/σ(I)>	31.6	8.2
Completeness [%]	100.0	100
Redundancy	7.8	7
CC(1/2)		0.974

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP		298	16% PEG4000, 100mM Tris, pH8.5, 200mM MgCl2