Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.3",
"uuid": "e373843613ba8841d90192faa9593bed",
"space_group_name": "H 3 2",
"unit_cell": {
"a": 78.970,
"b": 78.970,
"c": 233.288,
"alpha": 90.0,
"beta": 90.0,
"gamma": 120.0
},
"wavelengths": [0.98000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [44.38,1.62],
"number_observations_unique": 36099,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.100
},
{
"type": "R(meas)",
"value": 0.112
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 16.7
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 9.9
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [44.38,8.87],
"number_observations_unique": 266,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "R(meas)",
"value": 0.035
},
{
"type": "R(pim)",
"value": 0.016
},
{
"type": "I/SigI",
"value": 54.3
},
{
"type": "Completeness",
"value": 99.3
},
{
"type": "Redundancy",
"value": 7.1
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
{
"resolution_limits": [1.65,1.62],
"number_observations_unique": 1764,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.218
},
{
"type": "R(meas)",
"value": 1.360
},
{
"type": "R(pim)",
"value": 0.599
},
{
"type": "I/SigI",
"value": 2.2
},
{
"type": "Completeness",
"value": 100.0
},
{
"type": "Redundancy",
"value": 10.0
},
{
"type": "CC(1/2)",
"value": 0.697
}
]
}
]
}