Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "52419aa247821f721e4898c057404322",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 50.379,
"b": 55.676,
"c": 53.031,
"alpha": 90.00,
"beta": 116.02,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.66,2.04],
"number_observations_unique": 16684,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.2
},
{
"type": "R(pim)",
"value": 0.145
},
{
"type": "I/SigI",
"value": 3.8
},
{
"type": "Completeness",
"value": 98.4
},
{
"type": "Redundancy",
"value": 6.1
},
{
"type": "CC(1/2)",
"value": 0.986
}
]
},
"refln_shells": [
{
"resolution_limits": [2.09,2.04],
"number_observations_unique": 1005,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.201
},
{
"type": "R(pim)",
"value": 0.822
},
{
"type": "I/SigI",
"value": 1.3
},
{
"type": "Completeness",
"value": 80
},
{
"type": "Redundancy",
"value": 5.3
},
{
"type": "CC(1/2)",
"value": 0.41
}
]
}
]
}