Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "599cba516326dde702855217eeff55f9",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 53.651,
"b": 80.153,
"c": 57.608,
"alpha": 90.00,
"beta": 114.42,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.850,2.100],
"number_observations": 196977,
"number_observations_unique": 26019,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.217
},
{
"type": "R(meas)",
"value": 0.233
},
{
"type": "R(pim)",
"value": 0.084
},
{
"type": "I/SigI",
"value": 11.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.600
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.210,2.100],
"number_observations": 28599,
"number_observations_unique": 3776,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.364
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 3.600
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 7.600
},
{
"type": "CC(1/2)",
"value": 0.668
}
]
},
{
"resolution_limits": [48.850,6.640],
"number_observations": 6360,
"number_observations_unique": 854,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.059
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 27.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}