Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ae211eb3b0ebb0578b1262dd048e5dd7",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 69.181,
"b": 69.181,
"c": 131.877,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99990],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.730,1.560],
"number_observations": 1154947,
"number_observations_unique": 46485,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "R(meas)",
"value": 0.096
},
{
"type": "R(pim)",
"value": 0.019
},
{
"type": "I/SigI",
"value": 27.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.590,1.560],
"number_observations": 53747,
"number_observations_unique": 2276,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.476
},
{
"type": "R(meas)",
"value": 0.486
},
{
"type": "R(pim)",
"value": 0.099
},
{
"type": "I/SigI",
"value": 8.100
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 23.600
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
{
"resolution_limits": [47.730,8.540],
"number_observations": 7420,
"number_observations_unique": 367,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 64.700
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 20.200
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}