Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "71cf871791d1032534a2e8755978c30f",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 40.067,
"b": 87.712,
"c": 88.043,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97949],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.020,1.970],
"number_observations": 141394,
"number_observations_unique": 22691,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.169
},
{
"type": "R(meas)",
"value": 0.185
},
{
"type": "R(pim)",
"value": 0.073
},
{
"type": "I/SigI",
"value": 7.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.200
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.020,1.970],
"number_observations": 10018,
"number_observations_unique": 1630,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.262
},
{
"type": "R(meas)",
"value": 1.378
},
{
"type": "R(pim)",
"value": 0.547
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.795
}
]
},
{
"resolution_limits": [44.020,8.810],
"number_observations": 1556,
"number_observations_unique": 310,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 14.200
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.987
}
]
}
]
}