Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "5416663b2c59ab2ea583bc308262aef8",
"space_group_name": "F 41 3 2",
"unit_cell": {
"a": 202.869,
"b": 202.869,
"c": 202.869,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97927],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [39.042,2.900],
"number_observations_unique": 8410,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.349
},
{
"type": "R(meas)",
"value": 0.362
},
{
"type": "R(pim)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 5.800
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 15.700
},
{
"type": "CC(1/2)",
"value": 0.948
}
]
},
"refln_shells": [
{
"resolution_limits": [3.080,2.900],
"number_observations_unique": 1313,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.335
},
{
"type": "R(meas)",
"value": 1.378
},
{
"type": "R(pim)",
"value": 0.341
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 16.200
},
{
"type": "CC(1/2)",
"value": 0.706
}
]
},
{
"resolution_limits": [39.04,8.7],
"number_observations_unique": 381,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.130
},
{
"type": "R(meas)",
"value": 0.138
},
{
"type": "R(pim)",
"value": 0.042
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 11.000
},
{
"type": "CC(1/2)",
"value": 0.916
}
]
}
]
}