Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9b689969ba116a0c5414a0de0acf4796",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 62.490,
"b": 62.490,
"c": 341.271,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.120,2.260],
"number_observations": 208313,
"number_observations_unique": 19514,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.137
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 10.900
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.390,2.260],
"number_observations": 23093,
"number_observations_unique": 2696,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.575
},
{
"type": "R(meas)",
"value": 1.663
},
{
"type": "R(pim)",
"value": 0.494
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 8.600
},
{
"type": "CC(1/2)",
"value": 0.417
}
]
},
{
"resolution_limits": [54.120,7.160],
"number_observations": 11510,
"number_observations_unique": 796,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.045
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "I/SigI",
"value": 40.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.500
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}