Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fd200a767cc1d0b5d4d03f612406177e",
"space_group_name": "P 62 2 2",
"unit_cell": {
"a": 97.446,
"b": 97.446,
"c": 193.972,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.45800],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.540,2.620],
"number_observations": 85436,
"number_observations_unique": 15940,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.126
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 94.200
},
{
"type": "Redundancy",
"value": 5.400
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.740,2.620],
"number_observations_unique": 1878,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.896
},
{
"type": "R(meas)",
"value": 0.983
},
{
"type": "R(pim)",
"value": 0.380
},
{
"type": "Completeness",
"value": 93.800
},
{
"type": "Redundancy",
"value": 5.300
},
{
"type": "CC(1/2)",
"value": 0.741
}
]
},
{
"resolution_limits": [43.540,9.080],
"number_observations_unique": 440,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.046
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "Completeness",
"value": 86.300
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}