Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7e0cb437ba34fd9ef6cc1e04ac66baa5",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 72.339,
"b": 53.382,
"c": 76.066,
"alpha": 90.00,
"beta": 100.15,
"gamma": 90.00
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.47,2.75],
"number_observations_unique": 15078,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.174
},
{
"type": "R(pim)",
"value": 0.09
},
{
"type": "I/SigI",
"value": 6.9
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 5.0
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
"refln_shells": [
{
"resolution_limits": [2.90,2.75],
"number_observations_unique": 2194,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.797
},
{
"type": "R(meas)",
"value": 0.896
},
{
"type": "R(pim)",
"value": 0.404
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "CC(1/2)",
"value": 0.590
}
]
}
]
}