Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "9a20b2d60885fd2dac2d41649f700794",
"space_group_name": "P 63 2 2",
"unit_cell": {
"a": 127.348,
"b": 127.348,
"c": 101.801,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [48.490,2.400],
"number_observations": 688445,
"number_observations_unique": 17876,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.140
},
{
"type": "R(meas)",
"value": 0.142
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 23.100
},
{
"type": "Completeness",
"value": 90.900
},
{
"type": "Redundancy",
"value": 38.500
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
},
"refln_shells": [
{
"resolution_limits": [2.490,2.400],
"number_observations": 80857,
"number_observations_unique": 1996,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.454
},
{
"type": "R(meas)",
"value": 5.522
},
{
"type": "R(pim)",
"value": 0.858
},
{
"type": "I/SigI",
"value": 1.100
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 40.500
},
{
"type": "CC(1/2)",
"value": 0.482
}
]
},
{
"resolution_limits": [48.490,8.970],
"number_observations": 13453,
"number_observations_unique": 457,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.035
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.007
},
{
"type": "I/SigI",
"value": 108.200
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 29.400
},
{
"type": "CC(1/2)",
"value": 1.000
}
]
}
]
}