Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ac998129ba382111b6f77dfaac8e2154",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 75.608,
"b": 134.112,
"c": 141.287,
"alpha": 90.00,
"beta": 93.16,
"gamma": 90.00
},
"wavelengths": [0.95370],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [49.300,2.990],
"number_observations": 182062,
"number_observations_unique": 56584,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(pim)",
"value": 0.053
},
{
"type": "I/SigI",
"value": 10.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [3.080,2.990],
"number_observations": 14563,
"number_observations_unique": 4554,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.468
},
{
"type": "R(pim)",
"value": 0.312
},
{
"type": "I/SigI",
"value": 2.600
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.768
}
]
},
{
"resolution_limits": [49.300,12.690],
"number_observations": 2356,
"number_observations_unique": 764,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.034
},
{
"type": "I/SigI",
"value": 20.500
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.989
}
]
}
]
}