7DV7

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

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	2018-10-19
Detector	DECTRIS PILATUS3 S 6M
Wavelength(s)	0.979
Spacegroup name	P 2 21 21
Unit cell lengths	55.820, 109.145, 150.075
Unit cell angles	90.00, 90.00, 90.00

Refinement procedure

Resolution	24.860 - 1.440
R-factor	0.1506
Rwork	0.150
R-free	0.16800
Structure solution method	MOLECULAR REPLACEMENT
Starting model (for MR)	3civ
RMSD bond length	0.013
RMSD bond angle	1.777
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	1.490
High resolution limit [Å]	1.440	1.440
Number of reflections	161843	13237
<I/σ(I)>	57.1
Completeness [%]	97.3
Redundancy	8.2
CC(1/2)	0.973	0.986

Crystallization Conditions

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