Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "49962ee5e81fafce73e00aa2a459cd70",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 72.504,
"b": 61.386,
"c": 65.246,
"alpha": 90.00,
"beta": 92.84,
"gamma": 90.00
},
"wavelengths": [0.92202],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [32.57,1.15],
"number_observations": 407117,
"number_observations_unique": 76404,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "R(meas)",
"value": 0.051
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 19.4
},
{
"type": "Completeness",
"value": 75.5
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.17,1.15],
"number_observations": 304,
"number_observations_unique": 302,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.877
},
{
"type": "R(meas)",
"value": 8.311
},
{
"type": "R(pim)",
"value": 5.877
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 1.0
},
{
"type": "CC(1/2)",
"value": 0.523
}
]
}
]
}