Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b12027d289402f39eb2240f88b9d4b09",
"space_group_name": "P 41 21 2",
"unit_cell": {
"a": 91.671,
"b": 91.671,
"c": 113.810,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [71.49,2.59],
"number_observations_unique": 15740,
"quality_factors": [
{
"type": "R(meas)",
"value": 0.398
},
{
"type": "R(pim)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 5.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 13.9
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [71.39,2.59],
"number_observations_unique": 15740,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 11.0
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
{
"resolution_limits": [2.71,2.59],
"number_observations_unique": 1900,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.121
},
{
"type": "R(meas)",
"value": 4.430
},
{
"type": "R(pim)",
"value": 1.618
},
{
"type": "Redundancy",
"value": 14.2
},
{
"type": "CC(1/2)",
"value": 0.432
}
]
}
]
}