Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "36b0eb94e3cabad490b311a79ef431ce",
"space_group_name": "P 1",
"unit_cell": {
"a": 59.184,
"b": 70.314,
"c": 85.682,
"alpha": 103.01,
"beta": 96.26,
"gamma": 112.07
},
"wavelengths": [0.91260],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [81.560,1.960],
"number_observations": 286947,
"number_observations_unique": 84285,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.056
},
{
"type": "I/SigI",
"value": 6.800
},
{
"type": "Completeness",
"value": 96.400
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.960],
"number_observations": 13031,
"number_observations_unique": 4175,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.053
},
{
"type": "R(meas)",
"value": 2.486
},
{
"type": "R(pim)",
"value": 1.375
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 90.400
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.293
}
]
},
{
"resolution_limits": [81.560,10.370],
"number_observations": 2269,
"number_observations_unique": 580,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 38.200
},
{
"type": "Completeness",
"value": 98.300
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}