Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4dba6e62b7e8dc2abdfa4ef67e15eea4",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 128.977,
"b": 69.507,
"c": 160.375,
"alpha": 90.00,
"beta": 94.84,
"gamma": 90.00
},
"wavelengths": [0.97860,0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.640,1.750],
"number_observations": 958644,
"number_observations_unique": 283662,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "R(pim)",
"value": 0.047
},
{
"type": "I/SigI",
"value": 10.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.780,1.750],
"number_observations": 47488,
"number_observations_unique": 14038,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.654
},
{
"type": "R(pim)",
"value": 0.415
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.697
}
]
},
{
"resolution_limits": [47.640,9.590],
"number_observations": 6229,
"number_observations_unique": 1851,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 24.900
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 3.400
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}