Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a2645ddb12c462f92572115658110826",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 37.390,
"b": 35.068,
"c": 37.910,
"alpha": 90.00,
"beta": 93.05,
"gamma": 90.00
},
"wavelengths": [0.91330],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.860,0.980],
"number_observations": 330609,
"number_observations_unique": 55493,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.033
},
{
"type": "R(meas)",
"value": 0.036
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "I/SigI",
"value": 25.100
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 6.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.000,0.980],
"number_observations": 12807,
"number_observations_unique": 2675,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.344
},
{
"type": "R(meas)",
"value": 0.386
},
{
"type": "R(pim)",
"value": 0.173
},
{
"type": "I/SigI",
"value": 3.600
},
{
"type": "Completeness",
"value": 97.500
},
{
"type": "Redundancy",
"value": 4.800
},
{
"type": "CC(1/2)",
"value": 0.949
}
]
},
{
"resolution_limits": [37.860,5.390],
"number_observations": 2089,
"number_observations_unique": 363,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.027
},
{
"type": "R(meas)",
"value": 0.030
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 60.900
},
{
"type": "Completeness",
"value": 97.800
},
{
"type": "Redundancy",
"value": 5.800
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}