Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c562b4e6c1911a74e5afd40c66638b80",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.737,
"b": 53.390,
"c": 44.556,
"alpha": 90.00,
"beta": 100.89,
"gamma": 90.00
},
"wavelengths": [0.91266],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.83,1.50],
"number_observations": 129219,
"number_observations_unique": 41790,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "R(meas)",
"value": 0.154
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 5.7
},
{
"type": "Completeness",
"value": 99.2
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.979
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.50],
"number_observations": 5053,
"number_observations_unique": 2010,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.957
},
{
"type": "R(meas)",
"value": 1.224
},
{
"type": "R(pim)",
"value": 0.751
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 2.5
},
{
"type": "CC(1/2)",
"value": 0.194
}
]
}
]
}