Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f88ffc9e00673223b5fd2ade1f505df7",
"space_group_name": "P 65 2 2",
"unit_cell": {
"a": 79.297,
"b": 79.297,
"c": 138.390,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [61.52,1.47],
"number_observations_unique": 44189,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.093
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 16.8
},
{
"type": "Completeness",
"value": 99.4
},
{
"type": "Redundancy",
"value": 20.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [61.52,8.05],
"number_observations_unique": 341,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.046
},
{
"type": "R(meas)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Redundancy",
"value": 15.5
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.50,1.47],
"number_observations_unique": 2048,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.861
},
{
"type": "R(meas)",
"value": 5.255
},
{
"type": "R(pim)",
"value": 1.903
},
{
"type": "Redundancy",
"value": 13.4
},
{
"type": "CC(1/2)",
"value": 0.254
}
]
}
]
}