Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "755bb71da2f4660a85feab756d511b99",
"space_group_name": "P 43 21 2",
"unit_cell": {
"a": 103.819,
"b": 103.819,
"c": 33.254,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.97600],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [46.430,1.600],
"number_observations": 206585,
"number_observations_unique": 24097,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.120
},
{
"type": "R(pim)",
"value": 0.043
},
{
"type": "I/SigI",
"value": 11.500
},
{
"type": "Completeness",
"value": 97.900
},
{
"type": "Redundancy",
"value": 8.600
},
{
"type": "CC(1/2)",
"value": 0.997
}
]
},
"refln_shells": [
{
"resolution_limits": [1.630,1.600],
"number_observations": 8611,
"number_observations_unique": 1057,
"quality_factors": [
{
"type": "R(merge)",
"value": 1.180
},
{
"type": "R(pim)",
"value": 0.433
},
{
"type": "I/SigI",
"value": 1.800
},
{
"type": "Completeness",
"value": 89.500
},
{
"type": "Redundancy",
"value": 8.100
},
{
"type": "CC(1/2)",
"value": 0.670
}
]
},
{
"resolution_limits": [46.430,8.770],
"number_observations": 1434,
"number_observations_unique": 201,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.069
},
{
"type": "R(pim)",
"value": 0.027
},
{
"type": "I/SigI",
"value": 25.000
},
{
"type": "Completeness",
"value": 99.400
},
{
"type": "Redundancy",
"value": 7.100
},
{
"type": "CC(1/2)",
"value": 0.996
}
]
}
]
}