7EQX

Crystal structure of an Aedes aegypti procarboxypeptidase B1

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	ROTATING ANODE
Source details	RIGAKU
Temperature [K]	100
Detector technology	IMAGE PLATE
Collection date	2017-10-20
Detector	RIGAKU RAXIS IV++
Wavelength(s)	1.54178
Spacegroup name	C 1 2 1
Unit cell lengths	139.797, 74.436, 83.108
Unit cell angles	90.00, 119.08, 90.00

Refinement procedure

Resolution	33.630 - 2.080
R-factor	0.169
Rwork	0.168
R-free	0.19800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	1jqg
RMSD bond length	0.003
RMSD bond angle	0.626
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	PHENIX (1.19.2_4158)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	50.000	2.160
High resolution limit [Å]	2.080	2.080
Number of reflections	44087	2867
<I/σ(I)>	27.74
Completeness [%]	98.4
Redundancy	5

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		293	0.2M Ammonium sulphate, 0.1M sodium cacodylate trihydrate pH 6.5, 30% w/v PEG 8000