Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9e03eaf9ca64a58a653c1fd72b30b48e",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 114.831,
"b": 114.831,
"c": 83.545,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.96770],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.320,1.930],
"number_observations_unique": 42266,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.072
},
{
"type": "R(meas)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.014
},
{
"type": "I/SigI",
"value": 29.300
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 27.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.000,1.930],
"number_observations_unique": 4084,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.024
},
{
"type": "R(meas)",
"value": 2.059
},
{
"type": "R(pim)",
"value": 0.380
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 28.700
},
{
"type": "CC(1/2)",
"value": 0.701
}
]
},
{
"resolution_limits": [47.320,7.480],
"number_observations_unique": 846,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(meas)",
"value": 0.061
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 19.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}