Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "dd4a29cb9c0cee2167d9c5ff044e27f5",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 71.155,
"b": 71.155,
"c": 149.620,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97630],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.280,1.560],
"number_observations": 557689,
"number_observations_unique": 55053,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.163
},
{
"type": "R(meas)",
"value": 0.171
},
{
"type": "R(pim)",
"value": 0.051
},
{
"type": "I/SigI",
"value": 8.900
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 10.100
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
"refln_shells": [
{
"resolution_limits": [1.590,1.560],
"number_observations": 14021,
"number_observations_unique": 2135,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.837
},
{
"type": "R(meas)",
"value": 0.904
},
{
"type": "R(pim)",
"value": 0.328
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 79.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.660
}
]
},
{
"resolution_limits": [29.280,8.540],
"number_observations": 4519,
"number_observations_unique": 423,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "R(meas)",
"value": 0.148
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 16.900
},
{
"type": "Completeness",
"value": 97.700
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.968
}
]
}
]
}