Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1ef09a53442632646482522d31e00c5c",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 41.212,
"b": 99.621,
"c": 48.322,
"alpha": 90.00,
"beta": 113.86,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50,1.66],
"number_observations_unique": 40502,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.078
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 32.06
},
{
"type": "Completeness",
"value": 97.7
},
{
"type": "Redundancy",
"value": 3.2
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [1.69,1.66],
"number_observations_unique": 1927,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.296
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 2.6
},
{
"type": "CC(1/2)",
"value": 0.803
}
]
}
]
}