Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "efc43f84134d935cc500a8c6a39da2c2",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 43.08,
"b": 92.98,
"c": 154.51,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [1.00000],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [90.000,2.900],
"number_observations_unique": 14386,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.092
},
{
"type": "I/SigI",
"value": 10.100
},
{
"type": "Completeness",
"value": 98.700
},
{
"type": "Redundancy",
"value": 7.000
}
]
},
"refln_shells": [
{
"resolution_limits": [3.00,2.90],
"number_observations_unique": 1274,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.657
},
{
"type": "Completeness",
"value": 90.70
},
{
"type": "Redundancy",
"value": 5.30
}
]
},
{
"resolution_limits": [3.12,3.00],
"number_observations_unique": 1411,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.494
},
{
"type": "Completeness",
"value": 98.50
},
{
"type": "Redundancy",
"value": 6.30
}
]
},
{
"resolution_limits": [3.27,3.12],
"number_observations_unique": 1412,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.269
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [3.44,3.27],
"number_observations_unique": 1428,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.211
},
{
"type": "Completeness",
"value": 99.80
},
{
"type": "Redundancy",
"value": 7.70
}
]
},
{
"resolution_limits": [3.65,3.44],
"number_observations_unique": 1424,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.160
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 7.60
}
]
},
{
"resolution_limits": [3.94,3.65],
"number_observations_unique": 1463,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.127
},
{
"type": "Completeness",
"value": 99.70
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [4.33,3.94],
"number_observations_unique": 1445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.094
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 7.10
}
]
},
{
"resolution_limits": [4.96,4.33],
"number_observations_unique": 1445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.088
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 6.60
}
]
},
{
"resolution_limits": [6.25,4.96],
"number_observations_unique": 1497,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.089
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 6.10
}
]
},
{
"resolution_limits": [90.00,6.25],
"number_observations_unique": 1587,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.047
},
{
"type": "Completeness",
"value": 99.50
},
{
"type": "Redundancy",
"value": 8.20
}
]
}
]
}