Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "e5be8d00a488d0d61eeeb657108ff733",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.617,
"b": 42.617,
"c": 217.132,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [41.820,1.880],
"number_observations": 269141,
"number_observations_unique": 17391,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.230
},
{
"type": "R(meas)",
"value": 0.238
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 8.500
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 15.500
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.980,1.880],
"number_observations": 40124,
"number_observations_unique": 2457,
"quality_factors": [
{
"type": "R(merge)",
"value": 9.387
},
{
"type": "R(meas)",
"value": 9.699
},
{
"type": "R(pim)",
"value": 2.381
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.300
},
{
"type": "CC(1/2)",
"value": 0.430
}
]
},
{
"resolution_limits": [41.820,5.940],
"number_observations": 8329,
"number_observations_unique": 659,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.053
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 31.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 12.600
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}