Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "7e0fe488902ac3608c8d233445dd9c91",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 86.855,
"b": 57.289,
"c": 64.780,
"alpha": 90.0,
"beta": 94.8,
"gamma": 90.0
},
"wavelengths": [0.92199],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [43.27,1.29],
"number_observations": 433585,
"number_observations_unique": 73555,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.113
},
{
"type": "R(meas)",
"value": 0.123
},
{
"type": "R(pim)",
"value": 0.049
},
{
"type": "I/SigI",
"value": 8.4
},
{
"type": "Completeness",
"value": 92.4
},
{
"type": "Redundancy",
"value": 5.9
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
},
"refln_shells": [
{
"resolution_limits": [1.31,1.29],
"number_observations": 6099,
"number_observations_unique": 2050,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.771
},
{
"type": "R(meas)",
"value": 2.121
},
{
"type": "R(pim)",
"value": 1.136
},
{
"type": "I/SigI",
"value": 0.3
},
{
"type": "Redundancy",
"value": 3.0
},
{
"type": "CC(1/2)",
"value": 0.224
}
]
}
]
}