Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f60d497731848313ae47107f6166fac6",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.497,
"b": 41.657,
"c": 72.496,
"alpha": 90.000,
"beta": 104.333,
"gamma": 90.000
},
"wavelengths": [0.91840],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.66,1.09],
"number_observations_unique": 98467,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.052
},
{
"type": "I/SigI",
"value": 13.47
},
{
"type": "Completeness",
"value": 97.2
},
{
"type": "Redundancy",
"value": 3.61
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.16,1.09],
"number_observations_unique": 14806,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.233
},
{
"type": "I/SigI",
"value": 4.50
},
{
"type": "Completeness",
"value": 91.1
},
{
"type": "Redundancy",
"value": 3.48
},
{
"type": "CC(1/2)",
"value": 0.93
}
]
}
]
}