Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b0d2275a4b711811358b96d29ed8e343",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 76.170,
"b": 74.360,
"c": 118.986,
"alpha": 90.00,
"beta": 96.57,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [27.020,1.810],
"number_observations": 240259,
"number_observations_unique": 59769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.087
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 10.300
},
{
"type": "Completeness",
"value": 99.800
},
{
"type": "Redundancy",
"value": 4.000
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.850,1.810],
"number_observations": 12493,
"number_observations_unique": 3386,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.456
},
{
"type": "R(pim)",
"value": 0.271
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 97.000
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.784
}
]
},
{
"resolution_limits": [27.020,9.060],
"number_observations": 1936,
"number_observations_unique": 494,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 20.400
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
}
]
}