Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ffc73e6bc0773607bf72a66a9dfc0527",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 74.368,
"b": 42.882,
"c": 102.648,
"alpha": 90.000,
"beta": 96.007,
"gamma": 90.000
},
"wavelengths": [0.97857],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.10,1.90],
"number_observations_unique": 25081,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.077
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.071
},
{
"type": "I/SigI",
"value": 8.7
},
{
"type": "Completeness",
"value": 97.9
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.94,1.90],
"number_observations_unique": 1628,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.363
},
{
"type": "R(meas)",
"value": 0.486
},
{
"type": "R(pim)",
"value": 0.320
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 97.0
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.861
}
]
}
]
}