5K1D

Crystal structure of a class C beta lactamase/compound1 complex

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	CCD
Collection date	2015-06-16
Detector	ADSC QUANTUM 315r
Wavelength(s)	1.2827
Spacegroup name	P 21 21 21
Unit cell lengths	49.625, 59.381, 112.833
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	38.079 - 1.940
R-factor	0.1905
Rwork	0.188
R-free	0.24450
RMSD bond length	0.007
RMSD bond angle	1.120
Data scaling software	HKL-2000
Refinement software	PHENIX (1.9_1692)

Data quality characteristics

	Overall
Low resolution limit [Å]	50.000
High resolution limit [Å]	1.940
Number of reflections	24395
<I/σ(I)>	52.81
Completeness [%]	95.7
Redundancy	9.3

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	MICROBATCH	6.5	295	Cadmium chloride, Na-Cacodylate, PEG 400