Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e57bb159f08204e0cc24e4d577a28439",
"space_group_name": "P 32 2 1",
"unit_cell": {
"a": 81.54,
"b": 81.54,
"c": 135.38,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97918],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [38.030,2.050],
"number_observations": 666142,
"number_observations_unique": 33390,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.095
},
{
"type": "R(meas)",
"value": 0.098
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 21.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.000
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.100,2.050],
"number_observations": 50166,
"number_observations_unique": 2447,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.892
},
{
"type": "R(meas)",
"value": 1.940
},
{
"type": "R(pim)",
"value": 0.427
},
{
"type": "I/SigI",
"value": 2.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 20.500
},
{
"type": "CC(1/2)",
"value": 0.837
}
]
},
{
"resolution_limits": [38.030,9.170],
"number_observations": 6460,
"number_observations_unique": 436,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.030
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.008
},
{
"type": "I/SigI",
"value": 63.500
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 14.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}