Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f9765059d6074410b111cb7a7bec1b37",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 70.485,
"b": 70.485,
"c": 195.664,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [97.880,2.080],
"number_observations": 806432,
"number_observations_unique": 30700,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.546
},
{
"type": "R(meas)",
"value": 0.557
},
{
"type": "R(pim)",
"value": 0.108
},
{
"type": "I/SigI",
"value": 5.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 26.300
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.140,2.080],
"number_observations": 67194,
"number_observations_unique": 2430,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.073
},
{
"type": "R(meas)",
"value": 31.838
},
{
"type": "R(pim)",
"value": 5.955
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 27.700
},
{
"type": "CC(1/2)",
"value": 0.293
}
]
},
{
"resolution_limits": [97.880,8.830],
"number_observations": 9849,
"number_observations_unique": 510,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.075
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 35.300
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 19.300
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}