Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "2e73d7e93a7c2b5f97bc0cdb69e0b779",
"space_group_name": "P 41",
"unit_cell": {
"a": 37.264,
"b": 37.264,
"c": 31.888,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.54000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [37.260,1.390],
"number_observations": 56048,
"number_observations_unique": 8924,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.056
},
{
"type": "R(meas)",
"value": 0.062
},
{
"type": "R(pim)",
"value": 0.025
},
{
"type": "I/SigI",
"value": 15.000
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 6.300
},
{
"type": "CC(1/2)",
"value": 0.995
}
]
},
"refln_shells": [
{
"resolution_limits": [1.410,1.390],
"number_observations": 1831,
"number_observations_unique": 430,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.659
},
{
"type": "R(meas)",
"value": 1.895
},
{
"type": "R(pim)",
"value": 0.905
},
{
"type": "I/SigI",
"value": 0.800
},
{
"type": "Completeness",
"value": 100.000
},
{
"type": "Redundancy",
"value": 4.300
},
{
"type": "CC(1/2)",
"value": 0.522
}
]
},
{
"resolution_limits": [37.260,7.610],
"number_observations": 389,
"number_observations_unique": 64,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.051
},
{
"type": "R(meas)",
"value": 0.056
},
{
"type": "R(pim)",
"value": 0.023
},
{
"type": "I/SigI",
"value": 42.400
},
{
"type": "Completeness",
"value": 99.500
},
{
"type": "Redundancy",
"value": 6.100
},
{
"type": "CC(1/2)",
"value": 0.993
}
]
}
]
}