Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "0c3de45569e7d25e205a9a91da7eabec",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 118.146,
"b": 38.686,
"c": 108.514,
"alpha": 90.00,
"beta": 116.74,
"gamma": 90.00
},
"wavelengths": [0.98400],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.46,1.95],
"number_observations_unique": 31355,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(meas)",
"value": 0.135
},
{
"type": "R(pim)",
"value": 0.093
},
{
"type": "I/SigI",
"value": 8.3
},
{
"type": "Completeness",
"value": 96.9
},
{
"type": "Redundancy",
"value": 3.5
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.00,1.95],
"number_observations_unique": 2098,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.725
},
{
"type": "R(meas)",
"value": 1.009
},
{
"type": "R(pim)",
"value": 0.700
},
{
"type": "I/SigI",
"value": 1.6
},
{
"type": "Completeness",
"value": 94.4
},
{
"type": "Redundancy",
"value": 3.3
},
{
"type": "CC(1/2)",
"value": 0.641
}
]
}
]
}