Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6e91a916eb9e86cd290991fc4d053367",
"space_group_name": "P 1",
"unit_cell": {
"a": 83.788,
"b": 83.687,
"c": 88.052,
"alpha": 106.63,
"beta": 109.09,
"gamma": 95.07
},
"wavelengths": [0.97850],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.250,2.300],
"number_observations": 398069,
"number_observations_unique": 86965,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.152
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 92.200
},
{
"type": "Redundancy",
"value": 4.600
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [2.340,2.300],
"number_observations": 16597,
"number_observations_unique": 4115,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.555
},
{
"type": "R(pim)",
"value": 0.296
},
{
"type": "I/SigI",
"value": 2.500
},
{
"type": "Completeness",
"value": 87.500
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.760
}
]
},
{
"resolution_limits": [49.250,12.600],
"number_observations": 3211,
"number_observations_unique": 559,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.108
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 16.300
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
}
]
}