Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "d22085694afc68ffe104409365bf50d2",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 36.29,
"b": 94.51,
"c": 99.94,
"alpha": 90.00,
"beta": 93.24,
"gamma": 90.00
},
"wavelengths": [0.94500,1.73978],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [47.260,1.600],
"number_observations": 332569,
"number_observations_unique": 87187,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.040
},
{
"type": "R(meas)",
"value": 0.047
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 19.500
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 3.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [1.660,1.600],
"number_observations_unique": 8413,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.436
},
{
"type": "R(meas)",
"value": 1.662
},
{
"type": "R(pim)",
"value": 0.828
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 3.900
},
{
"type": "CC(1/2)",
"value": 0.375
}
]
},
{
"resolution_limits": [47.260,6.200],
"number_observations_unique": 1537,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 3.600
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}