Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "67bc81494cf0420f31c56966271392c7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 41.404,
"b": 47.168,
"c": 57.265,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.99998],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.170,1.320],
"number_observations": 252428,
"number_observations_unique": 26691,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.107
},
{
"type": "R(meas)",
"value": 0.114
},
{
"type": "R(pim)",
"value": 0.036
},
{
"type": "I/SigI",
"value": 11.200
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 9.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.340,1.320],
"number_observations": 11730,
"number_observations_unique": 1254,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.294
},
{
"type": "R(meas)",
"value": 1.368
},
{
"type": "R(pim)",
"value": 0.437
},
{
"type": "I/SigI",
"value": 1.700
},
{
"type": "Completeness",
"value": 91.100
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.620
}
]
},
{
"resolution_limits": [47.170,7.080],
"number_observations": 1774,
"number_observations_unique": 221,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.058
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.020
},
{
"type": "I/SigI",
"value": 27.700
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 8.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}