Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "648dbc996e7498c1c91f02b9f06ee4e4",
"space_group_name": "P 21 2 21",
"unit_cell": {
"a": 52.408,
"b": 61.859,
"c": 168.824,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.90,2.30],
"number_observations": 302782,
"number_observations_unique": 25016,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.182
},
{
"type": "R(meas)",
"value": 0.190
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 10.5
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 12.1
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.38,2.30],
"number_observations": 27411,
"number_observations_unique": 2407,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.978
},
{
"type": "R(meas)",
"value": 1.021
},
{
"type": "R(pim)",
"value": 0.287
},
{
"type": "I/SigI",
"value": 3.5
},
{
"type": "Redundancy",
"value": 11.4
},
{
"type": "CC(1/2)",
"value": 0.935
}
]
}
]
}