Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "006e728e15f55c211a569aa8de1bdea4",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.85,
"b": 68.59,
"c": 138.13,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [60.900,2.250],
"number_observations": 198549,
"number_observations_unique": 31392,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.237
},
{
"type": "R(meas)",
"value": 0.259
},
{
"type": "R(pim)",
"value": 0.102
},
{
"type": "I/SigI",
"value": 6.400
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
},
"refln_shells": [
{
"resolution_limits": [2.310,2.250],
"number_observations": 11401,
"number_observations_unique": 2287,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.911
},
{
"type": "R(meas)",
"value": 3.262
},
{
"type": "R(pim)",
"value": 1.455
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 5.000
},
{
"type": "CC(1/2)",
"value": 0.394
}
]
},
{
"resolution_limits": [60.900,10.060],
"number_observations": 2351,
"number_observations_unique": 423,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(meas)",
"value": 0.054
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 22.600
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}