Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "130cb8f7fbae5ef9c7fa5bdf6c511da6",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.967,
"b": 43.113,
"c": 79.374,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95397],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.69,1.04],
"number_observations_unique": 59412,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.077
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 9.8
},
{
"type": "Completeness",
"value": 93.6
},
{
"type": "Redundancy",
"value": 5.7
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [39.69,5.70],
"number_observations_unique": 473,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.071
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "Redundancy",
"value": 5.6
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
{
"resolution_limits": [1.06,1.04],
"number_observations_unique": 1574,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.239
},
{
"type": "R(meas)",
"value": 1.700
},
{
"type": "R(pim)",
"value": 1.159
},
{
"type": "Redundancy",
"value": 1.9
},
{
"type": "CC(1/2)",
"value": 0.341
}
]
}
]
}