Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "031207d58e0dd79d4838edc0df673767",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 108.712,
"b": 108.712,
"c": 144.370,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.98010],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.617,2.280],
"number_observations": 321458,
"number_observations_unique": 40171,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.063
},
{
"type": "R(meas)",
"value": 0.067
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 18.100
},
{
"type": "Completeness",
"value": 99.700
},
{
"type": "Redundancy",
"value": 8.000
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.350,2.280],
"number_observations": 27624,
"number_observations_unique": 3549,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.564
},
{
"type": "R(meas)",
"value": 1.675
},
{
"type": "R(pim)",
"value": 0.589
},
{
"type": "I/SigI",
"value": 1.400
},
{
"type": "Completeness",
"value": 97.400
},
{
"type": "Redundancy",
"value": 7.800
},
{
"type": "CC(1/2)",
"value": 0.487
}
]
},
{
"resolution_limits": [60.140,9.110],
"number_observations": 4853,
"number_observations_unique": 723,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.028
},
{
"type": "R(meas)",
"value": 0.031
},
{
"type": "R(pim)",
"value": 0.011
},
{
"type": "I/SigI",
"value": 53.900
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 6.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}