Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "fcb522e2e27b6520bc970a4c3ceb24c3",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 58.962,
"b": 74.668,
"c": 124.555,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.83,2.50],
"number_observations": 251445,
"number_observations_unique": 19657,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.603
},
{
"type": "R(meas)",
"value": 0.628
},
{
"type": "R(pim)",
"value": 0.174
},
{
"type": "I/SigI",
"value": 5.2
},
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 12.8
},
{
"type": "CC(1/2)",
"value": 0.948
}
]
},
"refln_shells": [
{
"resolution_limits": [2.60,2.50],
"number_observations": 27927,
"number_observations_unique": 2156,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.856
},
{
"type": "R(meas)",
"value": 1.932
},
{
"type": "R(pim)",
"value": 0.531
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Redundancy",
"value": 13.0
},
{
"type": "CC(1/2)",
"value": 0.351
}
]
}
]
}