Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "454af5a041f5934d842cc18c4ec38cd1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 52.253,
"b": 118.259,
"c": 165.182,
"alpha": 90.00,
"beta": 90.18,
"gamma": 90.00
},
"wavelengths": [0.97900],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.42,1.87],
"number_observations": 1297779,
"number_observations_unique": 164286,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.165
},
{
"type": "R(meas)",
"value": 0.176
},
{
"type": "R(pim)",
"value": 0.059
},
{
"type": "I/SigI",
"value": 10.4
},
{
"type": "Completeness",
"value": 98.9
},
{
"type": "Redundancy",
"value": 7.9
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.90,1.87],
"number_observations": 32460,
"number_observations_unique": 7073,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.764
},
{
"type": "R(meas)",
"value": 2.009
},
{
"type": "R(pim)",
"value": 0.946
},
{
"type": "I/SigI",
"value": 1.1
},
{
"type": "Redundancy",
"value": 4.6
},
{
"type": "CC(1/2)",
"value": 0.557
}
]
}
]
}