Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d9509313fa6615c278108d50a9d2f7ff",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 68.28,
"b": 68.70,
"c": 138.99,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.860,2.360],
"number_observations": 181567,
"number_observations_unique": 27504,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.349
},
{
"type": "R(meas)",
"value": 0.379
},
{
"type": "R(pim)",
"value": 0.146
},
{
"type": "I/SigI",
"value": 4.900
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [2.420,2.360],
"number_observations": 13611,
"number_observations_unique": 1985,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.344
},
{
"type": "R(meas)",
"value": 3.614
},
{
"type": "R(pim)",
"value": 1.363
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.250
}
]
},
{
"resolution_limits": [48.860,10.550],
"number_observations": 1922,
"number_observations_unique": 374,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.065
},
{
"type": "R(pim)",
"value": 0.029
},
{
"type": "I/SigI",
"value": 18.200
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}