Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "daa61eb6c7087622093ae39e98cfd301",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 161.45,
"b": 177.86,
"c": 242.47,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.850,3.250],
"number_observations_unique": 104192,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.345
},
{
"type": "R(meas)",
"value": 0.351
},
{
"type": "R(pim)",
"value": 0.061
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 31.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [3.310,3.250],
"number_observations_unique": 2706,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.743
},
{
"type": "R(meas)",
"value": 2.870
},
{
"type": "R(pim)",
"value": 0.822
},
{
"type": "Completeness",
"value": 50.100
},
{
"type": "Redundancy",
"value": 11.300
},
{
"type": "CC(1/2)",
"value": 0.340
}
]
},
{
"resolution_limits": [39.850,17.800],
"number_observations_unique": 700,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "Completeness",
"value": 91.300
},
{
"type": "Redundancy",
"value": 34.300
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}