Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "1b2f7b0bcd5c2d89abe9ef45b16ee768",
"space_group_name": "C 1 2 1",
"unit_cell": {
"a": 257.354,
"b": 82.245,
"c": 116.581,
"alpha": 90.00,
"beta": 109.13,
"gamma": 90.00
},
"wavelengths": [1.54180],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [42.900,2.500],
"number_observations_unique": 78365,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.081
},
{
"type": "R(meas)",
"value": 0.084
},
{
"type": "R(pim)",
"value": 0.022
},
{
"type": "I/SigI",
"value": 32.700
},
{
"type": "Completeness",
"value": 98.100
},
{
"type": "Redundancy",
"value": 13.700
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
},
"refln_shells": [
{
"resolution_limits": [2.550,2.500],
"number_observations_unique": 3663,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.529
},
{
"type": "R(meas)",
"value": 0.559
},
{
"type": "R(pim)",
"value": 0.178
},
{
"type": "Completeness",
"value": 80.600
},
{
"type": "Redundancy",
"value": 9.400
},
{
"type": "CC(1/2)",
"value": 0.905
}
]
},
{
"resolution_limits": [42.900,12.750],
"number_observations_unique": 637,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "R(meas)",
"value": 0.040
},
{
"type": "R(pim)",
"value": 0.012
},
{
"type": "Completeness",
"value": 97.200
},
{
"type": "Redundancy",
"value": 11.800
},
{
"type": "CC(1/2)",
"value": 0.999
}
]
}
]
}