Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9a171dd17dc9fa609930060d8b80d470",
"space_group_name": "I 4",
"unit_cell": {
"a": 95.583,
"b": 95.583,
"c": 45.936,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.92124],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [33.790,1.570],
"number_observations": 395942,
"number_observations_unique": 29079,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.356
},
{
"type": "R(meas)",
"value": 0.370
},
{
"type": "R(pim)",
"value": 0.100
},
{
"type": "I/SigI",
"value": 3.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 13.600
},
{
"type": "CC(1/2)",
"value": 0.983
}
]
},
"refln_shells": [
{
"resolution_limits": [1.600,1.570],
"number_observations": 16778,
"number_observations_unique": 1425,
"quality_factors": [
{
"type": "R(merge)",
"value": 3.228
},
{
"type": "R(meas)",
"value": 3.376
},
{
"type": "R(pim)",
"value": 0.977
},
{
"type": "I/SigI",
"value": 0.300
},
{
"type": "Completeness",
"value": 99.300
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.265
}
]
},
{
"resolution_limits": [33.790,8.600],
"number_observations": 2368,
"number_observations_unique": 197,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.337
},
{
"type": "R(meas)",
"value": 0.354
},
{
"type": "R(pim)",
"value": 0.104
},
{
"type": "I/SigI",
"value": 11.600
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 12.000
},
{
"type": "CC(1/2)",
"value": 0.936
}
]
}
]
}