Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "10c9e5b1a3b3a7b1ab6ea8ccdd6ac55c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 38.63,
"b": 77.28,
"c": 99.02,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.920,1.740],
"number_observations": 200156,
"number_observations_unique": 31270,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.102
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 11.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.790,1.740],
"number_observations": 13061,
"number_observations_unique": 2252,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.743
},
{
"type": "R(meas)",
"value": 1.918
},
{
"type": "R(pim)",
"value": 0.792
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.373
}
]
},
{
"resolution_limits": [60.920,7.780],
"number_observations": 2357,
"number_observations_unique": 418,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.037
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 37.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}