Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3dc8f84c99a81efe504f7bbe2550e9da",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 115.269,
"b": 115.269,
"c": 242.005,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97947],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.580,3.500],
"number_observations": 193056,
"number_observations_unique": 21387,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.214
},
{
"type": "R(meas)",
"value": 0.227
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 11.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 9.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [3.780,3.500],
"number_observations_unique": 4299,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.794
},
{
"type": "R(meas)",
"value": 1.903
},
{
"type": "R(pim)",
"value": 0.628
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 8.700
},
{
"type": "CC(1/2)",
"value": 0.689
}
]
},
{
"resolution_limits": [48.580,9.260],
"number_observations_unique": 1304,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.027
},
{
"type": "R(pim)",
"value": 0.009
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 8.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}