Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "c1eb81704dcc92db11aa77fb24e60444",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 47.103,
"b": 84.737,
"c": 81.820,
"alpha": 90.00,
"beta": 98.48,
"gamma": 90.00
},
"wavelengths": [0.97915],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [80.930,2.190],
"number_observations": 194193,
"number_observations_unique": 32874,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.182
},
{
"type": "R(meas)",
"value": 0.200
},
{
"type": "R(pim)",
"value": 0.082
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.900
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.310,2.190],
"number_observations_unique": 4781,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.146
},
{
"type": "R(meas)",
"value": 0.9261
},
{
"type": "R(pim)",
"value": 0.518
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.683
}
]
},
{
"resolution_limits": [9.30,6.920],
"number_observations_unique": 1084,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}