Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8b7129f8a90f9b9bfeed3280c5730d9a",
"space_group_name": "P 43 2 2",
"unit_cell": {
"a": 42.582,
"b": 42.582,
"c": 217.116,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92134],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [54.280,2.150],
"number_observations": 255310,
"number_observations_unique": 11839,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.401
},
{
"type": "R(meas)",
"value": 0.411
},
{
"type": "R(pim)",
"value": 0.087
},
{
"type": "I/SigI",
"value": 6.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 21.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [2.270,2.150],
"number_observations": 37235,
"number_observations_unique": 1649,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.678
},
{
"type": "R(meas)",
"value": 5.809
},
{
"type": "R(pim)",
"value": 1.212
},
{
"type": "I/SigI",
"value": 0.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 22.600
},
{
"type": "CC(1/2)",
"value": 0.717
}
]
},
{
"resolution_limits": [54.280,6.800],
"number_observations": 7603,
"number_observations_unique": 481,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.104
},
{
"type": "R(meas)",
"value": 0.108
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 18.300
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 15.800
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}