Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1607e523670c8d18724139de62440944",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 37.793,
"b": 43.134,
"c": 78.998,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91163],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.50,1.12],
"number_observations_unique": 50545,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.1
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [39.50,6.13],
"number_observations_unique": 381,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "Redundancy",
"value": 11.1
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
{
"resolution_limits": [1.14,1.12],
"number_observations_unique": 2477,
"quality_factors": [
{
"type": "R(merge)",
"value": 6.039
},
{
"type": "R(meas)",
"value": 6.649
},
{
"type": "R(pim)",
"value": 2.759
},
{
"type": "Redundancy",
"value": 11.2
},
{
"type": "CC(1/2)",
"value": 0.439
}
]
}
]
}