{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "717e7c9ed12df4ab3eed33d3ecc79c3c",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 67.103,
"b": 84.140,
"c": 96.388,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.50],
"number_observations_unique": 40755,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.067
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 28.6
},
{
"type": "Completeness",
"value": 92.6
},
{
"type": "Redundancy",
"value": 7.6
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.50],
"number_observations_unique": 1309,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.79
},
{
"type": "R(meas)",
"value": 0.838
},
{
"type": "R(pim)",
"value": 0.314
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 60.2
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.851
}
]
}
]
}
|