Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9d0d405b1ec33fe803a7754d3c58a930",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 180.094,
"b": 43.336,
"c": 105.935,
"alpha": 90.00,
"beta": 125.29,
"gamma": 90.00
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [40,2.45],
"number_observations_unique": 23826,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.114
},
{
"type": "R(meas)",
"value": 0.133
},
{
"type": "R(pim)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 14.5
},
{
"type": "Completeness",
"value": 94.7
},
{
"type": "Redundancy",
"value": 3.0
}
]
},
"refln_shells": [
{
"resolution_limits": [2.49,2.45],
"number_observations_unique": 1143,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.528
},
{
"type": "R(meas)",
"value": 0.547
},
{
"type": "R(pim)",
"value": 0.325
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 92.4
},
{
"type": "Redundancy",
"value": 2.4
},
{
"type": "CC(1/2)",
"value": 0.628
}
]
}
]
}