Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "f4dd28a2a67539ef4c0cb5a8107396b0",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 9.019,
"b": 43.157,
"c": 9.392,
"alpha": 90.00,
"beta": 102.84,
"gamma": 90.00
},
"wavelengths": [0.97920],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,1.000],
"number_observations_unique": 3204,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.128
},
{
"type": "I/SigI",
"value": 11.700
},
{
"type": "Completeness",
"value": 83.500
},
{
"type": "Redundancy",
"value": 13.900
}
]
},
"refln_shells": [
{
"resolution_limits": [1.080,1.000],
"number_observations_unique": 353,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.397
},
{
"type": "Completeness",
"value": 46.800
},
{
"type": "Redundancy",
"value": 10.500
}
]
},
{
"resolution_limits": [1.190,1.080],
"number_observations_unique": 689,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.244
},
{
"type": "Completeness",
"value": 88.900
},
{
"type": "Redundancy",
"value": 13.800
}
]
},
{
"resolution_limits": [1.360,1.190],
"number_observations_unique": 695,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.187
},
{
"type": "Completeness",
"value": 91.700
},
{
"type": "Redundancy",
"value": 14.800
}
]
},
{
"resolution_limits": [1.710,1.360],
"number_observations_unique": 701,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.139
},
{
"type": "Completeness",
"value": 92.500
},
{
"type": "Redundancy",
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}
]
},
{
"resolution_limits": [90.000,1.710],
"number_observations_unique": 766,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "Completeness",
"value": 96.700
},
{
"type": "Redundancy",
"value": 14.100
}
]
}
]
}