Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f310880a5e8b5ce4e1110ec401ddef72",
"space_group_name": "P 1",
"unit_cell": {
"a": 18.425,
"b": 9.613,
"c": 21.975,
"alpha": 90.88,
"beta": 96.12,
"gamma": 100.93
},
"wavelengths": [0.94660],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.700],
"number_observations_unique": 820,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.172
},
{
"type": "I/SigI",
"value": 3.900
},
{
"type": "Completeness",
"value": 93.000
}
]
},
"refln_shells": [
{
"resolution_limits": [1.83,1.70],
"number_observations_unique": 299,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.413
},
{
"type": "Completeness",
"value": 91.70
}
]
},
{
"resolution_limits": [2.02,1.83],
"number_observations_unique": 296,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.32
},
{
"type": "Completeness",
"value": 88.60
}
]
},
{
"resolution_limits": [2.31,2.02],
"number_observations_unique": 311,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.241
},
{
"type": "Completeness",
"value": 96.60
}
]
},
{
"resolution_limits": [2.91,2.31],
"number_observations_unique": 296,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.191
},
{
"type": "Completeness",
"value": 93.10
}
]
},
{
"resolution_limits": [90.00,2.91],
"number_observations_unique": 321,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "Completeness",
"value": 95.30
}
]
}
]
}