Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8e6903fe583af82462aacb92208b128b",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 34.92,
"b": 47.34,
"c": 78.37,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97852],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [78.370,2.120],
"number_observations": 54180,
"number_observations_unique": 7346,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "R(pim)",
"value": 0.039
},
{
"type": "I/SigI",
"value": 10.800
},
{
"type": "Completeness",
"value": 94.100
},
{
"type": "Redundancy",
"value": 7.400
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
},
"refln_shells": [
{
"resolution_limits": [2.180,2.120],
"number_observations": 5202,
"number_observations_unique": 640,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.251
},
{
"type": "R(pim)",
"value": 0.094
},
{
"type": "I/SigI",
"value": 5.700
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.100
},
{
"type": "CC(1/2)",
"value": 0.985
}
]
},
{
"resolution_limits": [78.370,8.990],
"number_observations": 863,
"number_observations_unique": 133,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 16.400
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 6.500
},
{
"type": "CC(1/2)",
"value": 0.991
}
]
}
]
}