Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b8f7c6523e463a15e3f855ce7bbcd8be",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 45.917,
"b": 82.096,
"c": 79.885,
"alpha": 90.00,
"beta": 106.59,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.01,1.9],
"number_observations_unique": 86421,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "R(meas)",
"value": 0.1
},
{
"type": "R(pim)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 12.9
},
{
"type": "Completeness",
"value": 98.55
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [1.94,1.9],
"number_observations_unique": 4092,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.206
},
{
"type": "R(meas)",
"value": 0.23
},
{
"type": "R(pim)",
"value": 0.1
},
{
"type": "I/SigI",
"value": 6.1
},
{
"type": "Completeness",
"value": 92.04
},
{
"type": "Redundancy",
"value": 4.9
},
{
"type": "CC(1/2)",
"value": 0.964
}
]
}
]
}