Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "860f722d3cce6f135181c1de0b0f8c0f",
"space_group_name": "I 2 2 2",
"unit_cell": {
"a": 119.657,
"b": 137.562,
"c": 178.996,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97946],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.140,2.190],
"number_observations": 231612,
"number_observations_unique": 51233,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.156
},
{
"type": "R(meas)",
"value": 0.186
},
{
"type": "R(pim)",
"value": 0.101
},
{
"type": "I/SigI",
"value": 5.500
},
{
"type": "Completeness",
"value": 96.100
},
{
"type": "Redundancy",
"value": 3.200
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [2.240,2.190],
"number_observations": 7430,
"number_observations_unique": 3637,
"quality_factors": [
{
"type": "R(merge)",
"value": 5.921
},
{
"type": "R(meas)",
"value": 7.776
},
{
"type": "R(pim)",
"value": 4.972
},
{
"type": "I/SigI",
"value": 0.100
},
{
"type": "Completeness",
"value": 78.000
},
{
"type": "Redundancy",
"value": 2.000
},
{
"type": "CC(1/2)",
"value": 0.126
}
]
},
{
"resolution_limits": [45.140,10.730],
"number_observations": 2058,
"number_observations_unique": 671,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.024
},
{
"type": "R(meas)",
"value": 0.029
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 31.700
},
{
"type": "Completeness",
"value": 94.600
},
{
"type": "Redundancy",
"value": 3.100
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}