Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "257245c782695d2b65e4066f9835a278",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 46.496,
"b": 94.289,
"c": 269.026,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [67.347,1.74],
"number_observations_unique": 121808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.090
},
{
"type": "R(meas)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.037
},
{
"type": "I/SigI",
"value": 16.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [67.26,9.55],
"number_observations_unique": 884,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.018
},
{
"type": "Redundancy",
"value": 9.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.77,1.74],
"number_observations_unique": 5957,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.102
},
{
"type": "R(meas)",
"value": 1.194
},
{
"type": "R(pim)",
"value": 0.457
},
{
"type": "Redundancy",
"value": 12.9
},
{
"type": "CC(1/2)",
"value": 0.788
}
]
}
]
}