Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "fbb8db337591101e8145f2ff86c520f1",
"space_group_name": "P 1 21 1",
"unit_cell": {
"a": 84.749,
"b": 66.966,
"c": 86.616,
"alpha": 90.00,
"beta": 93.53,
"gamma": 90.00
},
"wavelengths": [0.97945,0.96421],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [50.000,1.910],
"number_observations_unique": 74332,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.074
},
{
"type": "I/SigI",
"value": 11.800
},
{
"type": "Completeness",
"value": 98.400
},
{
"type": "Redundancy",
"value": 7.200
}
]
},
"refln_shells": [
{
"resolution_limits": [1.98,1.91],
"number_observations_unique": 6358,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.451
},
{
"type": "Completeness",
"value": 84.60
},
{
"type": "Redundancy",
"value": 4.40
}
]
},
{
"resolution_limits": [2.06,1.98],
"number_observations_unique": 7470,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.370
},
{
"type": "Completeness",
"value": 99.40
},
{
"type": "Redundancy",
"value": 6.30
}
]
},
{
"resolution_limits": [2.15,2.06],
"number_observations_unique": 7502,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.294
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.40
}
]
},
{
"resolution_limits": [2.26,2.15],
"number_observations_unique": 7493,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.206
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.70
}
]
},
{
"resolution_limits": [2.41,2.26],
"number_observations_unique": 7552,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.151
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.70
}
]
},
{
"resolution_limits": [2.59,2.41],
"number_observations_unique": 7504,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.123
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.70
}
]
},
{
"resolution_limits": [2.85,2.59],
"number_observations_unique": 7551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.097
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.70
}
]
},
{
"resolution_limits": [3.27,2.85],
"number_observations_unique": 7578,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.70
}
]
},
{
"resolution_limits": [4.11,3.27],
"number_observations_unique": 7581,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.060
},
{
"type": "Completeness",
"value": 100.00
},
{
"type": "Redundancy",
"value": 7.70
}
]
},
{
"resolution_limits": [50.00,4.11],
"number_observations_unique": 7743,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.049
},
{
"type": "Completeness",
"value": 99.90
},
{
"type": "Redundancy",
"value": 7.60
}
]
}
]
}