5X88

A crystal structure of cutinases from Malbranchea cinnamomea

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL17U
Synchrotron site	SSRF
Beamline	BL17U
Temperature [K]	80
Detector technology	CCD
Collection date	2016-10-13
Detector	MARMOSAIC 225 mm CCD
Wavelength(s)	1.0
Spacegroup name	P 21 2 21
Unit cell lengths	34.407, 37.815, 127.967
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	28.300 - 1.760
Rwork	0.172
R-free	0.17540
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHENIX
Refinement software	PHENIX (v1.11.1)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	28.300	1.823
High resolution limit [Å]	1.760	1.760
Rmerge	0.068
Number of reflections	16910	1626
<I/σ(I)>	266.8
Completeness [%]	98.0
Redundancy	6.8

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	PEG 3350,Potassium chloride