Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6f793fc3f79c6b14cb3adce8b807abc3",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 131.107,
"b": 42.351,
"c": 56.175,
"alpha": 90.00,
"beta": 94.76,
"gamma": 90.00
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [55.98,1.35],
"number_observations_unique": 67816,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.297
},
{
"type": "R(meas)",
"value": 0.309
},
{
"type": "R(pim)",
"value": 0.086
},
{
"type": "I/SigI",
"value": 9.7
},
{
"type": "Completeness",
"value": 99.9
},
{
"type": "Redundancy",
"value": 25.0
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.37,1.35],
"number_observations_unique": 3424,
"quality_factors": [
{
"type": "R(merge)",
"value": 6.455
},
{
"type": "R(meas)",
"value": 6.880
},
{
"type": "R(pim)",
"value": 2.319
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Completeness",
"value": 98.8
},
{
"type": "Redundancy",
"value": 17.0
},
{
"type": "CC(1/2)",
"value": 0.327
}
]
}
]
}