Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "830d04c5b2cdad202b76547a1b087178",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.959,
"b": 101.967,
"c": 146.355,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.11583],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.780,1.780],
"number_observations": 410714,
"number_observations_unique": 62047,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.062
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.026
},
{
"type": "I/SigI",
"value": 16.000
},
{
"type": "Completeness",
"value": 97.300
},
{
"type": "Redundancy",
"value": 6.600
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.820,1.780],
"number_observations": 20852,
"number_observations_unique": 3404,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.553
},
{
"type": "R(meas)",
"value": 2.788
},
{
"type": "R(pim)",
"value": 1.104
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 94.300
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.274
}
]
},
{
"resolution_limits": [48.780,9.090],
"number_observations": 3499,
"number_observations_unique": 575,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.015
},
{
"type": "R(meas)",
"value": 0.017
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 70.300
},
{
"type": "Completeness",
"value": 99.200
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}