Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "3204a8b9e06394976d09224c99176543",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 68.125,
"b": 67.928,
"c": 138.368,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91788],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [69.190,2.290],
"number_observations": 198620,
"number_observations_unique": 29721,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.318
},
{
"type": "R(meas)",
"value": 0.345
},
{
"type": "R(pim)",
"value": 0.133
},
{
"type": "I/SigI",
"value": 2.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.975
}
]
},
"refln_shells": [
{
"resolution_limits": [2.370,2.290],
"number_observations": 19691,
"number_observations_unique": 2848,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.102
},
{
"type": "R(meas)",
"value": 2.273
},
{
"type": "R(pim)",
"value": 0.859
},
{
"type": "I/SigI",
"value": 0.400
},
{
"type": "Completeness",
"value": 98.900
},
{
"type": "Redundancy",
"value": 6.900
},
{
"type": "CC(1/2)",
"value": 0.380
}
]
},
{
"resolution_limits": [69.190,8.860],
"number_observations": 3377,
"number_observations_unique": 605,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.066
},
{
"type": "R(meas)",
"value": 0.072
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 18.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 5.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
}
]
}