Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "4bdfe142becf7a787abd8739a50692b3",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 76.985,
"b": 76.985,
"c": 261.476,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97950],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [65.370,1.560],
"number_observations_unique": 66509,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.141
},
{
"type": "R(meas)",
"value": 0.143
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 16.700
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 38.800
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.590,1.560],
"number_observations": 127674,
"number_observations_unique": 3231,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.486
},
{
"type": "R(meas)",
"value": 2.518
},
{
"type": "R(pim)",
"value": 0.399
},
{
"type": "I/SigI",
"value": 1.900
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 39.500
},
{
"type": "CC(1/2)",
"value": 0.845
}
]
},
{
"resolution_limits": [65.370,8.540],
"number_observations": 15049,
"number_observations_unique": 540,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.006
},
{
"type": "I/SigI",
"value": 62.300
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 27.900
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}