Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "a12b0a967a2d2355fd21dec449bd1fa4",
"space_group_name": "P 61 2 2",
"unit_cell": {
"a": 57.861,
"b": 57.861,
"c": 395.379,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.91587],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [197.660,1.770],
"number_observations": 736223,
"number_observations_unique": 40215,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.201
},
{
"type": "R(meas)",
"value": 0.207
},
{
"type": "R(pim)",
"value": 0.048
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 18.300
},
{
"type": "CC(1/2)",
"value": 0.988
}
]
},
"refln_shells": [
{
"resolution_limits": [1.820,1.770],
"number_observations": 50965,
"number_observations_unique": 2909,
"quality_factors": [
{
"type": "R(merge)",
"value": 2.981
},
{
"type": "R(meas)",
"value": 3.071
},
{
"type": "R(pim)",
"value": 0.731
},
{
"type": "I/SigI",
"value": 1.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 17.500
},
{
"type": "CC(1/2)",
"value": 0.541
}
]
},
{
"resolution_limits": [197.660,7.920],
"number_observations": 9020,
"number_observations_unique": 631,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.042
},
{
"type": "R(meas)",
"value": 0.045
},
{
"type": "R(pim)",
"value": 0.013
},
{
"type": "I/SigI",
"value": 41.200
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 14.300
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}