Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8d489458cf658d7dd0f2a610394570ed",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 40.842,
"b": 64.434,
"c": 53.473,
"alpha": 90.000,
"beta": 95.035,
"gamma": 90.000
},
"wavelengths": [0.95373],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.05,1.5],
"number_observations_unique": 43909,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.052
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 20
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.53,1.50],
"number_observations_unique": 2114,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.373
},
{
"type": "R(meas)",
"value": 0.438
},
{
"type": "R(pim)",
"value": 0.229
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Completeness",
"value": 98.1
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.94
}
]
}
]
}