Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "4f45ccc2a9b814c01c6c89deb04b9e03",
"space_group_name": "P 65",
"unit_cell": {
"a": 149.63,
"b": 149.63,
"c": 97.73,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.0,1.9],
"number_observations_unique": 97582,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.06
},
{
"type": "I/SigI",
"value": 19.94
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 7.5
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
"refln_shells": [
{
"resolution_limits": [2.0,1.90],
"number_observations_unique": 13637,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.033
},
{
"type": "R(meas)",
"value": 1.117
},
{
"type": "CC(1/2)",
"value": 0.695
}
]
},
{
"resolution_limits": [2.2,2.00],
"number_observations_unique": 20798,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.487
},
{
"type": "R(meas)",
"value": 0.522
},
{
"type": "CC(1/2)",
"value": 0.92
}
]
},
{
"resolution_limits": [2.5,2.20],
"number_observations_unique": 20002,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.211
},
{
"type": "R(meas)",
"value": 0.226
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
},
{
"resolution_limits": [3.0,2.50],
"number_observations_unique": 18085,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "R(meas)",
"value": 0.094
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [3.8,3.00],
"number_observations_unique": 12663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.041
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [4.7,3.80],
"number_observations_unique": 5817,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.026
},
{
"type": "R(meas)",
"value": 0.028
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [5.1,4.70],
"number_observations_unique": 1403,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [8.0,5.10],
"number_observations_unique": 3808,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
{
"resolution_limits": [12.0,8.00],
"number_observations_unique": 960,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.021
},
{
"type": "R(meas)",
"value": 0.023
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
},
{
"resolution_limits": [50.0,12.00],
"number_observations_unique": 409,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.026
},
{
"type": "CC(1/2)",
"value": 1.0
}
]
}
]
}