Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a4bae6018218dbf990b6cb9ba6ff1b76",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.120,
"b": 42.120,
"c": 216.191,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.050,2.240],
"number_observations": 251201,
"number_observations_unique": 10299,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.635
},
{
"type": "R(meas)",
"value": 0.648
},
{
"type": "R(pim)",
"value": 0.130
},
{
"type": "I/SigI",
"value": 5.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.400
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.360,2.240],
"number_observations": 35667,
"number_observations_unique": 1451,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.175
},
{
"type": "R(meas)",
"value": 9.367
},
{
"type": "R(pim)",
"value": 1.867
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.600
},
{
"type": "CC(1/2)",
"value": 0.529
}
]
},
{
"resolution_limits": [54.050,7.070],
"number_observations": 7509,
"number_observations_unique": 421,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.115
},
{
"type": "R(meas)",
"value": 0.119
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 16.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.800
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
}
]
}