Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6486bc5a94a18355904b103f3791e32a",
"space_group_name": "P 31 2 1",
"unit_cell": {
"a": 241.281,
"b": 241.281,
"c": 125.298,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.64,3.070],
"number_observations_unique": 77258,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.164
},
{
"type": "R(meas)",
"value": 0.173
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 9.700
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 10.100
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [3.140,3.070],
"number_observations_unique": 3944,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.841
},
{
"type": "R(meas)",
"value": 1.952
},
{
"type": "R(pim)",
"value": 0.631
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 85.600
},
{
"type": "Redundancy",
"value": 8.900
},
{
"type": "CC(1/2)",
"value": 0.518
}
]
},
{
"resolution_limits": [39.640,15.370],
"number_observations_unique": 647,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.065
},
{
"type": "R(meas)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 18.6
},
{
"type": "Completeness",
"value": 94.500
},
{
"type": "Redundancy",
"value": 9.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}