Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fc175a8b0e9549d303268d8556913914",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 180.619,
"b": 78.989,
"c": 58.923,
"alpha": 90.000,
"beta": 92.191,
"gamma": 90.000
},
"wavelengths": [0.97620],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.244,1.85],
"number_observations_unique": 70688,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "R(meas)",
"value": 0.152
},
{
"type": "R(pim)",
"value": 0.081
},
{
"type": "I/SigI",
"value": 8.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 6.8
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [90.24,9.06],
"number_observations_unique": 4318,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.025
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.015
},
{
"type": "Redundancy",
"value": 6.7
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
{
"resolution_limits": [1.89,1.85],
"number_observations_unique": 30079,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.823
},
{
"type": "R(meas)",
"value": 2.156
},
{
"type": "R(pim)",
"value": 1.142
},
{
"type": "Redundancy",
"value": 6.9
},
{
"type": "CC(1/2)",
"value": 0.500
}
]
}
]
}