Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "6324bef0e9e4001e7316c8da4255472e",
"space_group_name": "C 2 2 21",
"unit_cell": {
"a": 77.148,
"b": 192.058,
"c": 344.581,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.12710],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.650,2.800],
"number_observations_unique": 63589,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.223
},
{
"type": "R(meas)",
"value": 0.227
},
{
"type": "R(pim)",
"value": 0.044
},
{
"type": "I/SigI",
"value": 15.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 26.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [2.870,2.800],
"number_observations_unique": 4416,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.712
},
{
"type": "R(meas)",
"value": 4.797
},
{
"type": "R(pim)",
"value": 0.896
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 28.000
},
{
"type": "CC(1/2)",
"value": 0.312
}
]
},
{
"resolution_limits": [49.650,12.830],
"number_observations_unique": 738,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.044
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 19.900
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}