Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "276551bb643d9b74b39c65f4d8581b15",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 153.696,
"b": 47.611,
"c": 64.142,
"alpha": 90.00,
"beta": 107.12,
"gamma": 90.00
},
"wavelengths": [0.97930],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [61.300,1.550],
"number_observations": 234457,
"number_observations_unique": 63987,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "R(pim)",
"value": 0.030
},
{
"type": "I/SigI",
"value": 14.000
},
{
"type": "Completeness",
"value": 99.000
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.998
}
]
},
"refln_shells": [
{
"resolution_limits": [1.580,1.550],
"number_observations": 11664,
"number_observations_unique": 3167,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.659
},
{
"type": "R(pim)",
"value": 0.398
},
{
"type": "I/SigI",
"value": 2.200
},
{
"type": "Completeness",
"value": 99.100
},
{
"type": "Redundancy",
"value": 3.700
},
{
"type": "CC(1/2)",
"value": 0.716
}
]
},
{
"resolution_limits": [61.300,8.490],
"number_observations": 737,
"number_observations_unique": 266,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.034
},
{
"type": "R(pim)",
"value": 0.024
},
{
"type": "I/SigI",
"value": 29.400
},
{
"type": "Completeness",
"value": 60.900
},
{
"type": "Redundancy",
"value": 2.800
},
{
"type": "CC(1/2)",
"value": 0.984
}
]
}
]
}