Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8a822bae15c89e2a5945c504f31d5d81",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 134.844,
"b": 53.846,
"c": 195.640,
"alpha": 90.00,
"beta": 91.73,
"gamma": 90.00
},
"wavelengths": [1.54056],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [29.070,2.500],
"number_observations": 215997,
"number_observations_unique": 49161,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.084
},
{
"type": "R(meas)",
"value": 0.096
},
{
"type": "R(pim)",
"value": 0.045
},
{
"type": "I/SigI",
"value": 13.600
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.580,2.500],
"number_observations_unique": 4481,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.781
},
{
"type": "R(meas)",
"value": 0.889
},
{
"type": "R(pim)",
"value": 0.418
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.400
},
{
"type": "CC(1/2)",
"value": 0.777
}
]
},
{
"resolution_limits": [2.68,2.58],
"number_observations_unique": 4478,
"quality_factors": [
{
"type": "Completeness",
"value": 99.8
},
{
"type": "Redundancy",
"value": 4.4
},
{
"type": "CC(1/2)",
"value": 0.775
}
]
}
]
}