9BCY

Crystal structure of Mayaro virus capsid C-terminal domain

This is a non-PDB format compatible entry.

Experimental procedure

Experimental method	SINGLE WAVELENGTH
Source type	SYNCHROTRON
Source details	LNLS SIRIUS BEAMLINE MANACA
Synchrotron site	LNLS SIRIUS
Beamline	MANACA
Temperature [K]	100
Detector technology	PIXEL
Collection date	2021-12-01
Detector	DECTRIS PILATUS 2M
Wavelength(s)	0.9772
Spacegroup name	P 1
Unit cell lengths	39.160, 40.112, 56.511
Unit cell angles	93.58, 94.40, 111.92

Refinement procedure

Resolution	37.057 - 1.180
Rwork	0.165
R-free	0.18060
Structure solution method	MOLECULAR REPLACEMENT
RMSD bond length	0.016
RMSD bond angle	1.786
Data reduction software	XDS
Data scaling software	SCALA
Phasing software	BALBES
Refinement software	REFMAC (5.8.0258)

Data quality characteristics

	Overall	Outer shell
Low resolution limit [Å]	37.057	1.222
High resolution limit [Å]	1.180	1.180
Rmerge	0.058	0.092
Rmeas	0.069	0.108
Rpim	0.037	0.057
Number of reflections	96920	8699
<I/σ(I)>	16.96	10.72
Completeness [%]	93.1
Redundancy	3.6
CC(1/2)	0.994	0.988

Crystallization Conditions

crystal ID	method	pH	temperature	details
1	VAPOR DIFFUSION, HANGING DROP	7.2	291	22% PEG 3350, 100mM Bis-Tris pH 7.2