Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2fe5e58c1cb39f5d9893654fbe1de36d",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 51.984,
"b": 111.159,
"c": 164.702,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.0667,1.8947],
"number_observations_unique": 76612,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.200
},
{
"type": "R(meas)",
"value": 0.208
},
{
"type": "R(pim)",
"value": 0.054
},
{
"type": "I/SigI",
"value": 7.700
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 14.500
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.930,1.8947],
"number_observations_unique": 4247,
"quality_factors": [
{
"type": "R(merge)",
"value": 4.655
},
{
"type": "R(meas)",
"value": 4.923
},
{
"type": "R(pim)",
"value": 1.538
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 8.500
},
{
"type": "CC(1/2)",
"value": 0.646
}
]
},
{
"resolution_limits": [39.060,9.470],
"number_observations_unique": 724,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.054
},
{
"type": "R(meas)",
"value": 0.057
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 98.800
},
{
"type": "Redundancy",
"value": 14.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}