Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b5c48ed5f04cc8e38b63a3f8f0be573c",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 51.85,
"b": 57.22,
"c": 115.16,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [31.880,1.560],
"number_observations": 322497,
"number_observations_unique": 48575,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.096
},
{
"type": "R(meas)",
"value": 0.105
},
{
"type": "R(pim)",
"value": 0.040
},
{
"type": "I/SigI",
"value": 11.400
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.600,1.560],
"number_observations": 24302,
"number_observations_unique": 3483,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.539
},
{
"type": "R(meas)",
"value": 1.662
},
{
"type": "R(pim)",
"value": 0.623
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 7.000
},
{
"type": "CC(1/2)",
"value": 0.783
}
]
},
{
"resolution_limits": [31.880,6.980],
"number_observations": 3902,
"number_observations_unique": 638,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 45.300
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}