Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "13720b3c28669f0ad5f778c0ee0fc2c7",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 52.34,
"b": 57.41,
"c": 115.18,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [57.590,1.470],
"number_observations": 374477,
"number_observations_unique": 59526,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.064
},
{
"type": "R(meas)",
"value": 0.070
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 15.600
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.510,1.470],
"number_observations": 24287,
"number_observations_unique": 4297,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.723
},
{
"type": "R(meas)",
"value": 1.905
},
{
"type": "R(pim)",
"value": 0.799
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 98.500
},
{
"type": "Redundancy",
"value": 5.700
},
{
"type": "CC(1/2)",
"value": 0.614
}
]
},
{
"resolution_limits": [57.590,6.570],
"number_observations": 4680,
"number_observations_unique": 782,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.029
},
{
"type": "R(meas)",
"value": 0.032
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 52.600
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}