Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9996ce03c10c3c0e07ff8a2487fee695",
"space_group_name": "P 21 21 2",
"unit_cell": {
"a": 165.13,
"b": 87.75,
"c": 117.13,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [64.630,1.900],
"number_observations_unique": 133932,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.105
},
{
"type": "I/SigI",
"value": 10.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.930,1.900],
"number_observations": 45238,
"number_observations_unique": 6541,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.899
},
{
"type": "R(meas)",
"value": 0.971
},
{
"type": "R(pim)",
"value": 0.366
},
{
"type": "I/SigI",
"value": 1.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.846
}
]
},
{
"resolution_limits": [64.630,10.410],
"number_observations": 10769,
"number_observations_unique": 943,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.041
},
{
"type": "R(meas)",
"value": 0.043
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 62.300
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 11.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}