Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "8df1e410c779f082bfd0f19c7be26cbb",
"space_group_name": "P 63",
"unit_cell": {
"a": 150.214,
"b": 150.214,
"c": 111.567,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91258],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [130.080,1.960],
"number_observations": 1007687,
"number_observations_unique": 102340,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.180
},
{
"type": "R(meas)",
"value": 0.190
},
{
"type": "R(pim)",
"value": 0.060
},
{
"type": "I/SigI",
"value": 7.000
},
{
"type": "Completeness",
"value": 99.900
},
{
"type": "Redundancy",
"value": 9.800
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.990,1.960],
"number_observations": 44337,
"number_observations_unique": 5016,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.941
},
{
"type": "R(meas)",
"value": 3.123
},
{
"type": "R(pim)",
"value": 1.047
},
{
"type": "I/SigI",
"value": 0.600
},
{
"type": "Completeness",
"value": 98.600
},
{
"type": "Redundancy",
"value": 8.800
},
{
"type": "CC(1/2)",
"value": 0.381
}
]
},
{
"resolution_limits": [130.080,10.740],
"number_observations": 7103,
"number_observations_unique": 666,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.032
},
{
"type": "R(meas)",
"value": 0.033
},
{
"type": "R(pim)",
"value": 0.010
},
{
"type": "I/SigI",
"value": 32.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 10.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}