7DVZ

Structure of a novel beta-mannanase BaMan113A from Bacillus sp. N16-5, N236Y mutation.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	SSRF BEAMLINE BL19U1
Synchrotron site	SSRF
Beamline	BL19U1
Temperature [K]	100
Detector technology	PIXEL
Collection date	2019-10-04
Detector	DECTRIS PILATUS 6M
Wavelength(s)	0.979
Spacegroup name	P 2 21 21
Unit cell lengths	55.936, 150.634, 108.648
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.880 - 2.000
R-factor	0.1423
Rwork	0.141
R-free	0.17260
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3icv
RMSD bond length	0.011
RMSD bond angle	1.498
Data reduction software	HKL-2000
Data scaling software	HKL-2000
Phasing software	PHASER
Refinement software	REFMAC (5.8.0257)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	25.000	2.070
High resolution limit [Å]	2.000	2.000
Number of reflections	62836	6171
<I/σ(I)>	17.2
Completeness [%]	100.0
Redundancy	9.8
CC(1/2)	0.955	0.971

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, SITTING DROP		295	tacsimate pH 7.0