Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "46c6d30db8d41993d29e66d72eeabe9b",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 37.71,
"b": 95.51,
"c": 117.22,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [74.040,1.820],
"number_observations": 186551,
"number_observations_unique": 18615,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.154
},
{
"type": "R(meas)",
"value": 0.163
},
{
"type": "R(pim)",
"value": 0.050
},
{
"type": "I/SigI",
"value": 8.400
},
{
"type": "Completeness",
"value": 96.300
},
{
"type": "Redundancy",
"value": 10.000
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.860,1.820],
"number_observations": 11311,
"number_observations_unique": 1120,
"quality_factors": [
{
"type": "R(merge)",
"value": 7.212
},
{
"type": "R(meas)",
"value": 7.611
},
{
"type": "R(pim)",
"value": 2.376
},
{
"type": "I/SigI",
"value": 0.500
},
{
"type": "Completeness",
"value": 98.200
},
{
"type": "Redundancy",
"value": 10.100
},
{
"type": "CC(1/2)",
"value": 0.218
}
]
},
{
"resolution_limits": [74.040,9.110],
"number_observations": 1946,
"number_observations_unique": 192,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.055
},
{
"type": "R(meas)",
"value": 0.058
},
{
"type": "R(pim)",
"value": 0.017
},
{
"type": "I/SigI",
"value": 27.300
},
{
"type": "Completeness",
"value": 98.000
},
{
"type": "Redundancy",
"value": 10.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}