Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f5532c6c34cbd7296a01465ab53cf948",
"space_group_name": "I 1 2 1",
"unit_cell": {
"a": 92.620,
"b": 81.939,
"c": 144.165,
"alpha": 90.000,
"beta": 94.386,
"gamma": 90.000
},
"wavelengths": [1.54184],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [23.310357633,2.00],
"number_observations_unique": 72440,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.103
},
{
"type": "R(meas)",
"value": 0.115
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 10.5
},
{
"type": "Completeness",
"value": 99.7
},
{
"type": "Redundancy",
"value": 5.1
},
{
"type": "CC(1/2)",
"value": 0.994
}
]
},
"refln_shells": [
{
"resolution_limits": [2.04,2.00],
"number_observations": 13298,
"number_observations_unique": 4397,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.638
},
{
"type": "R(meas)",
"value": 0.775
},
{
"type": "R(pim)",
"value": 0.432
},
{
"type": "I/SigI",
"value": 1.7
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.544
}
]
}
]
}