Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f413236824772ccf5b3222f270c44320",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 65.86,
"b": 90.04,
"c": 100.21,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97919],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [66.980,1.660],
"number_observations": 431180,
"number_observations_unique": 35402,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.149
},
{
"type": "R(meas)",
"value": 0.156
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 17.000
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 12.200
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.700,1.660],
"number_observations": 27615,
"number_observations_unique": 2601,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.833
},
{
"type": "R(meas)",
"value": 1.928
},
{
"type": "R(pim)",
"value": 0.592
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.600
},
{
"type": "CC(1/2)",
"value": 0.466
}
]
},
{
"resolution_limits": [66.980,7.420],
"number_observations": 4361,
"number_observations_unique": 445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.044
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 42.200
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}