Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8644c3b2aa1796f854b9c16093be9e23",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.669,
"b": 73.232,
"c": 95.455,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.95372],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.773,1.65],
"number_observations_unique": 37696,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(meas)",
"value": 0.092
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 15.9
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 19.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [47.73,9.04],
"number_observations_unique": 288,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "Redundancy",
"value": 15.9
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [1.68,1.65],
"number_observations_unique": 1862,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.654
},
{
"type": "R(meas)",
"value": 1.790
},
{
"type": "R(pim)",
"value": 0.671
},
{
"type": "Redundancy",
"value": 13.0
},
{
"type": "CC(1/2)",
"value": 0.764
}
]
}
]
}