Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d56cdce702301d8c438065445936ca81",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 146.408,
"b": 160.012,
"c": 245.478,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.430,2.800],
"number_observations": 1975241,
"number_observations_unique": 142096,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.275
},
{
"type": "R(meas)",
"value": 0.285
},
{
"type": "R(pim)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 9.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.850,2.800],
"number_observations": 99181,
"number_observations_unique": 6938,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.058
},
{
"type": "R(meas)",
"value": 2.134
},
{
"type": "R(pim)",
"value": 0.562
},
{
"type": "I/SigI",
"value": 1.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.300
},
{
"type": "CC(1/2)",
"value": 0.603
}
]
},
{
"resolution_limits": [49.430,15.340],
"number_observations": 11114,
"number_observations_unique": 969,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 30.900
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 11.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}