Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "72f87251830a1ee86c0234e27e938654",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 121.898,
"b": 61.666,
"c": 79.766,
"alpha": 90.000,
"beta": 117.519,
"gamma": 90.000
},
"wavelengths": [1.00003],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [53.56,2.26],
"number_observations_unique": 12980,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.125
},
{
"type": "R(meas)",
"value": 0.146
},
{
"type": "R(pim)",
"value": 0.076
},
{
"type": "I/SigI",
"value": 8.8
},
{
"type": "Completeness",
"value": 88.1
},
{
"type": "Redundancy",
"value": 3.7
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.57,2.26],
"number_observations_unique": 650,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.811
},
{
"type": "R(meas)",
"value": 0.961
},
{
"type": "R(pim)",
"value": 0.508
},
{
"type": "I/SigI",
"value": 1.5
},
{
"type": "Completeness",
"value": 66.1
},
{
"type": "Redundancy",
"value": 3.4
},
{
"type": "CC(1/2)",
"value": 0.713
}
]
}
]
}