Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "14a0425b1ea8607ec527689a10984aa8",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.55,
"b": 42.55,
"c": 217.21,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [72.400,2.190],
"number_observations": 277053,
"number_observations_unique": 11220,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.410
},
{
"type": "R(meas)",
"value": 0.419
},
{
"type": "R(pim)",
"value": 0.083
},
{
"type": "I/SigI",
"value": 6.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 24.700
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.250,2.190],
"number_observations": 21100,
"number_observations_unique": 815,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.085
},
{
"type": "R(meas)",
"value": 68.471
},
{
"type": "R(pim)",
"value": 13.337
},
{
"type": "I/SigI",
"value": 0.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 25.900
},
{
"type": "CC(1/2)",
"value": 0.355
}
]
},
{
"resolution_limits": [72.400,9.790],
"number_observations": 2470,
"number_observations_unique": 184,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 22.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 13.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}