Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f21436ccef6ca802e6496be3eea16b64",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 59.71,
"b": 98.31,
"c": 73.50,
"alpha": 90.00,
"beta": 110.41,
"gamma": 90.00
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [98.31,2.40],
"number_observations": 204575,
"number_observations_unique": 31100,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.079
},
{
"type": "R(meas)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 15.7
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 6.6
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.49,2.40],
"number_observations": 21232,
"number_observations_unique": 3256,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.663
},
{
"type": "R(meas)",
"value": 0.720
},
{
"type": "R(pim)",
"value": 0.279
},
{
"type": "I/SigI",
"value": 4.2
},
{
"type": "Redundancy",
"value": 6.5
},
{
"type": "CC(1/2)",
"value": 0.880
}
]
}
]
}