Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "91a735d901bd338c5291b824c100aeae",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 113.439,
"b": 37.107,
"c": 100.287,
"alpha": 90.000,
"beta": 112.279,
"gamma": 90.000
},
"wavelengths": [1.52131],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [92.97,1.52],
"number_observations_unique": 56594,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.110
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 7.7
},
{
"type": "Completeness",
"value": 94.21
},
{
"type": "Redundancy",
"value": 5.5
}
]
},
"refln_shells": [
{
"resolution_limits": [1.75,1.71],
"number_observations_unique": 2931,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.457
},
{
"type": "R(meas)",
"value": 0.506
},
{
"type": "R(pim)",
"value": 0.214
},
{
"type": "I/SigI",
"value": 1.4
},
{
"type": "Completeness",
"value": 99.57
},
{
"type": "Redundancy",
"value": 5.35
},
{
"type": "CC(1/2)",
"value": 0.833
}
]
}
]
}