Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7d137579876fd499534e52d16543c768",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 99.304,
"b": 156.957,
"c": 220.028,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97860],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.430,2.850],
"number_observations": 491072,
"number_observations_unique": 40545,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "R(meas)",
"value": 0.179
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 13.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.970,2.850],
"number_observations": 55103,
"number_observations_unique": 4524,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.652
},
{
"type": "R(meas)",
"value": 1.724
},
{
"type": "R(pim)",
"value": 0.489
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.833
}
]
},
{
"resolution_limits": [48.430,10.280],
"number_observations": 10841,
"number_observations_unique": 952,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.043
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 38.700
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 11.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}