Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7b51b75a6cf3026bb42bc8d8c4969f91",
"space_group_name": "P 41 2 2",
"unit_cell": {
"a": 118.775,
"b": 118.775,
"c": 53.873,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97890],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.56,1.6],
"number_observations_unique": 51378,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(meas)",
"value": 0.076
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 34.6
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 26.1
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [37.56,8.76],
"number_observations_unique": 385,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.018
},
{
"type": "R(meas)",
"value": 0.019
},
{
"type": "R(pim)",
"value": 0.004
},
{
"type": "I/SigI",
"value": 106.7
},
{
"type": "Completeness",
"value": 99.1
},
{
"type": "Redundancy",
"value": 19.8
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
{
"resolution_limits": [1.63,1.6],
"number_observations_unique": 2520,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.353
},
{
"type": "R(meas)",
"value": 1.379
},
{
"type": "R(pim)",
"value": 0.268
},
{
"type": "I/SigI",
"value": 3.0
},
{
"type": "Completeness",
"value": 100
},
{
"type": "Redundancy",
"value": 26.2
},
{
"type": "CC(1/2)",
"value": 0.857
}
]
}
]
}