Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "b4ecd0a51548542a685360068b5f7655",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 67.72,
"b": 91.00,
"c": 98.57,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97919],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [30.210,2.060],
"number_observations": 204182,
"number_observations_unique": 17561,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.150
},
{
"type": "R(meas)",
"value": 0.158
},
{
"type": "R(pim)",
"value": 0.046
},
{
"type": "I/SigI",
"value": 10.400
},
{
"type": "Completeness",
"value": 91.400
},
{
"type": "Redundancy",
"value": 11.600
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [2.110,2.060],
"number_observations": 14481,
"number_observations_unique": 1386,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.174
},
{
"type": "R(meas)",
"value": 1.235
},
{
"type": "R(pim)",
"value": 0.378
},
{
"type": "I/SigI",
"value": 2.300
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 10.400
},
{
"type": "CC(1/2)",
"value": 0.699
}
]
},
{
"resolution_limits": [30.210,9.210],
"number_observations": 2063,
"number_observations_unique": 239,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.083
},
{
"type": "R(meas)",
"value": 0.088
},
{
"type": "R(pim)",
"value": 0.028
},
{
"type": "I/SigI",
"value": 20.900
},
{
"type": "Completeness",
"value": 94.400
},
{
"type": "Redundancy",
"value": 8.600
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
}
]
}