Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d045094db3b524198091aedf9a79ce9b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 67.36,
"b": 67.97,
"c": 137.96,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [68.980,2.290],
"number_observations": 193467,
"number_observations_unique": 29295,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.285
},
{
"type": "R(meas)",
"value": 0.310
},
{
"type": "R(pim)",
"value": 0.120
},
{
"type": "I/SigI",
"value": 4.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
},
"refln_shells": [
{
"resolution_limits": [2.350,2.290],
"number_observations": 14537,
"number_observations_unique": 2122,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.602
},
{
"type": "R(meas)",
"value": 3.899
},
{
"type": "R(pim)",
"value": 1.482
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.310
}
]
},
{
"resolution_limits": [68.980,10.240],
"number_observations": 2017,
"number_observations_unique": 394,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.082
},
{
"type": "R(pim)",
"value": 0.035
},
{
"type": "I/SigI",
"value": 17.100
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 5.100
},
{
"type": "CC(1/2)",
"value": 0.992
}
]
}
]
}