Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "4c9cfe218bd2f916202dc01d9f4d5c3c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 42.209,
"b": 41.057,
"c": 71.909,
"alpha": 90.00,
"beta": 104.31,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.06,1.41],
"number_observations": 315201,
"number_observations_unique": 45706,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 25.4
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.49,1.41],
"number_observations": 44721,
"number_observations_unique": 6601,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.393
},
{
"type": "R(meas)",
"value": 0.457
},
{
"type": "R(pim)",
"value": 0.174
},
{
"type": "I/SigI",
"value": 4.6
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.916
}
]
}
]
}