Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "78f8fd1d06d08c39463b9c2ac6907da6",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 166.046,
"b": 223.243,
"c": 192.764,
"alpha": 90.00,
"beta": 100.48,
"gamma": 90.00
},
"wavelengths": [0.97741],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.37,3.56],
"number_observations": 576376,
"number_observations_unique": 82439,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.537
},
{
"type": "R(meas)",
"value": 0.581
},
{
"type": "R(pim)",
"value": 0.218
},
{
"type": "I/SigI",
"value": 4.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 7.0
},
{
"type": "CC(1/2)",
"value": 0.978
}
]
},
"refln_shells": [
{
"resolution_limits": [3.63,3.56],
"number_observations": 32805,
"number_observations_unique": 4518,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.967
},
{
"type": "R(meas)",
"value": 4.272
},
{
"type": "R(pim)",
"value": 1.577
},
{
"type": "I/SigI",
"value": 0.5
},
{
"type": "Redundancy",
"value": 7.3
},
{
"type": "CC(1/2)",
"value": 0.220
}
]
}
]
}