Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a17aaf85e4c8712ac70952bc1fb2a254",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 74.647,
"b": 74.647,
"c": 160.831,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [64.646,2.243],
"number_observations": 232197,
"number_observations_unique": 12111,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.188
},
{
"type": "R(meas)",
"value": 0.194
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 12.900
},
{
"type": "Completeness",
"value": 93.300
},
{
"type": "Redundancy",
"value": 19.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.546,2.243],
"number_observations": 11545,
"number_observations_unique": 608,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.074
},
{
"type": "R(meas)",
"value": 2.131
},
{
"type": "R(pim)",
"value": 0.484
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 80.300
},
{
"type": "Redundancy",
"value": 19.000
},
{
"type": "CC(1/2)",
"value": 0.583
}
]
},
{
"resolution_limits": [64.646,8.188],
"number_observations": 10517,
"number_observations_unique": 604,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.050
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 38.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 17.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}