Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d0c06cf4433fc10dd7b0a16d36c7f413",
"space_group_name": "P 1",
"unit_cell": {
"a": 51.751,
"b": 54.437,
"c": 64.018,
"alpha": 99.541,
"beta": 95.379,
"gamma": 102.644
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [52.13,1.65],
"number_observations_unique": 77677,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.091
},
{
"type": "R(meas)",
"value": 0.129
},
{
"type": "R(pim)",
"value": 0.091
},
{
"type": "I/SigI",
"value": 6.0
},
{
"type": "Completeness",
"value": 96.9
},
{
"type": "Redundancy",
"value": 3.1
},
{
"type": "CC(1/2)",
"value": 0.976
}
]
},
"refln_shells": [
{
"resolution_limits": [52.13,8.89],
"number_observations_unique": 513,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.015
},
{
"type": "R(meas)",
"value": 0.022
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 31.0
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.873
}
]
},
{
"resolution_limits": [1.68,1.65],
"number_observations_unique": 3887,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.614
},
{
"type": "R(meas)",
"value": 2.283
},
{
"type": "R(pim)",
"value": 1.614
},
{
"type": "I/SigI",
"value": 0.7
},
{
"type": "Completeness",
"value": 95.2
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.345
}
]
}
]
}